1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide

C249H428N64O15S2 — CID 160722989

IUPAC1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide
SMILESC/N=C(\C)N.C/N=C(\C)N1CCCC1.CC(=O)N1CCCC1.CC(N)=NO.CC1=NCCN1C.CCN(C)C.CCN(C)C1=NCCO1.CCN1CCN(C)CC1.CCN1CCOCC1.CCNC1=NCCO1.CN1CCCNCC1.CN1CCOCC1.CON=C(C)N.Cc1cc[nH]c(=O)c1.Cc1cccc(C(N)=O)c1.Cc1cccc(CN(C)C)c1.Cc1cccc(CN)c1.Cc1ccccc1C(N)=O.Cc1ccccc1CN.Cc1ccccc1CN(C)C.Cc1ccccc1CN1CCCC1.Cc1ccccc1CNC1=NCCN1.Cc1ccccc1CNC1=NCCN1C.Cc1ccccc1S(C)(=O)=O.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(C(N)=O)c1.Cc1ccnc(N)c1.[H]/N=C(/c1ccccc1C)N(C)C.[H]/N=C(\C)N.[H]/N=C(\C)N(C)C.[H]/N=C(\C)N(C)C.[H]/N=C(\C)N1CCC(C)CC1.[H]/N=C(\C)N1CCC(C)CC1.[H]/N=C(\C)N1CCCC1.[H]/N=C(\N)N1CCC(C)CC1.[H]/N=C(\N)N1CCN(C)CC1.[H]/N=C(\N)c1ccccc1C
InChIInChI=1S/C12H17N3.C12H17N.C11H15N3.C10H14N2.2C10H15N.2C8H16N2.C8H10N2.2C8H9NO.2C8H11N.C8H10O2S.C7H15N3.C7H8N2O.C7H14N2.C7H16N2.C7H9NO2S.C6H14N4.C6H12N2O.C6H14N2.C6H8N2.C6H12N2.C6H7NO.C6H11NO.C6H13NO.C5H10N2O.C5H10N2.C5H11NO.2C4H10N2.C4H11N.C3H8N2O.C3H8N2.C2H6N2O.C2H6N2/c1-10-5-3-4-6-11(10)9-14-12-13-7-8-15(12)2;1-11-6-2-3-7-12(11)10-13-8-4-5-9-13;1-9-4-2-3-5-10(9)8-14-11-12-6-7-13-11;1-8-6-4-5-7-9(8)10(11)12(2)3;1-9-5-4-6-10(7-9)8-11(2)3;1-9-6-4-5-7-10(9)8-11(2)3;2*1-7-3-5-10(6-4-7)8(2)9;1-6-4-2-3-5-7(6)8(9)10;1-6-3-2-4-7(5-6)8(9)10;1-6-4-2-3-5-7(6)8(9)10;1-7-3-2-4-8(5-7)6-9;1-7-4-2-3-5-8(7)6-9;1-7-5-3-4-6-8(7)11(2,9)10;1-6-2-4-10(5-3-6)7(8)9;1-5-2-3-9-6(4-5)7(8)10;1-7(8-2)9-5-3-4-6-9;1-3-9-6-4-8(2)5-7-9;1-6-4-2-3-5-7(6)11(8,9)10;1-9-2-4-10(5-3-9)6(7)8;1-3-8(2)6-7-4-5-9-6;1-8-5-2-3-7-4-6-8;1-5-2-3-8-6(7)4-5;1-6(7)8-4-2-3-5-8;1-5-2-3-7-6(8)4-5;1-6(8)7-4-2-3-5-7;1-2-7-3-5-8-6-4-7;1-2-6-5-7-3-4-8-5;1-5-6-3-4-7(5)2;1-6-2-4-7-5-3-6;2*1-4(5)6(2)3;1-4-5(2)3;1-3(4)5-6-2;1-3(4)5-2;1-2(3)4-5;1-2(3)4/h3-6H,7-9H2,1-2H3,(H,13,14);2-3,6-7H,4-5,8-10H2,1H3;2-5H,6-8H2,1H3,(H2,12,13,14);4-7,11H,1-3H3;2*4-7H,8H2,1-3H3;2*7,9H,3-6H2,1-2H3;2-5H,1H3,(H3,9,10);2*2-5H,1H3,(H2,9,10);2*2-5H,6,9H2,1H3;3-6H,1-2H3;6H,2-5H2,1H3,(H3,8,9);2-4H,1H3,(H2,8,10);3-6H2,1-2H3;3-7H2,1-2H3;2-5H,1H3,(H2,8,9,10);2-5H2,1H3,(H3,7,8);3-5H2,1-2H3;7H,2-6H2,1H3;2-4H,1H3,(H2,7,8);7H,2-5H2,1H3;2-4H,1H3,(H,7,8);2-5H2,1H3;2-6H2,1H3;2-4H2,1H3,(H,6,7);3-4H2,1-2H3;2-5H2,1H3;2*5H,1-3H3;4H2,1-3H3;1-2H3,(H2,4,5);1-2H3,(H2,4,5);5H,1H3,(H2,3,4);1H3,(H3,3,4)/b;;;11-10-;;;2*9-8+;;;;;;;;;8-7+;;;;;;;7-6+;;;;;;;2*5-4+;;;;;
InChIKeyRTIPRAOTPKZCCN-MFHJLTARSA-N
MW4622.73 g/mol
LogP29.96
Rot. Bonds25

About 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide

1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide (PubChem CID 160722989) has the molecular formula C249H428N64O15S2 and a molecular weight of 4622.73 g/mol. Its IUPAC name is 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide.

Molecular Properties

Compound Name1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide
PubChem CID160722989
Molecular FormulaC249H428N64O15S2
Molecular Weight4622.73 g/mol
Exact Mass4619.41
IUPAC Name1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide
SMILESC/N=C(\C)N.C/N=C(\C)N1CCCC1.CC(=O)N1CCCC1.CC(N)=NO.CC1=NCCN1C.CCN(C)C.CCN(C)C1=NCCO1.CCN1CCN(C)CC1.CCN1CCOCC1.CCNC1=NCCO1.CN1CCCNCC1.CN1CCOCC1.CON=C(C)N.Cc1cc[nH]c(=O)c1.Cc1cccc(C(N)=O)c1.Cc1cccc(CN(C)C)c1.Cc1cccc(CN)c1.Cc1ccccc1C(N)=O.Cc1ccccc1CN.Cc1ccccc1CN(C)C.Cc1ccccc1CN1CCCC1.Cc1ccccc1CNC1=NCCN1.Cc1ccccc1CNC1=NCCN1C.Cc1ccccc1S(C)(=O)=O.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(C(N)=O)c1.Cc1ccnc(N)c1.[H]/N=C(/c1ccccc1C)N(C)C.[H]/N=C(\C)N.[H]/N=C(\C)N(C)C.[H]/N=C(\C)N(C)C.[H]/N=C(\C)N1CCC(C)CC1.[H]/N=C(\C)N1CCC(C)CC1.[H]/N=C(\C)N1CCCC1.[H]/N=C(\N)N1CCC(C)CC1.[H]/N=C(\N)N1CCN(C)CC1.[H]/N=C(\N)c1ccccc1C
InChIInChI=1S/C12H17N3.C12H17N.C11H15N3.C10H14N2.2C10H15N.2C8H16N2.C8H10N2.2C8H9NO.2C8H11N.C8H10O2S.C7H15N3.C7H8N2O.C7H14N2.C7H16N2.C7H9NO2S.C6H14N4.C6H12N2O.C6H14N2.C6H8N2.C6H12N2.C6H7NO.C6H11NO.C6H13NO.C5H10N2O.C5H10N2.C5H11NO.2C4H10N2.C4H11N.C3H8N2O.C3H8N2.C2H6N2O.C2H6N2/c1-10-5-3-4-6-11(10)9-14-12-13-7-8-15(12)2;1-11-6-2-3-7-12(11)10-13-8-4-5-9-13;1-9-4-2-3-5-10(9)8-14-11-12-6-7-13-11;1-8-6-4-5-7-9(8)10(11)12(2)3;1-9-5-4-6-10(7-9)8-11(2)3;1-9-6-4-5-7-10(9)8-11(2)3;2*1-7-3-5-10(6-4-7)8(2)9;1-6-4-2-3-5-7(6)8(9)10;1-6-3-2-4-7(5-6)8(9)10;1-6-4-2-3-5-7(6)8(9)10;1-7-3-2-4-8(5-7)6-9;1-7-4-2-3-5-8(7)6-9;1-7-5-3-4-6-8(7)11(2,9)10;1-6-2-4-10(5-3-6)7(8)9;1-5-2-3-9-6(4-5)7(8)10;1-7(8-2)9-5-3-4-6-9;1-3-9-6-4-8(2)5-7-9;1-6-4-2-3-5-7(6)11(8,9)10;1-9-2-4-10(5-3-9)6(7)8;1-3-8(2)6-7-4-5-9-6;1-8-5-2-3-7-4-6-8;1-5-2-3-8-6(7)4-5;1-6(7)8-4-2-3-5-8;1-5-2-3-7-6(8)4-5;1-6(8)7-4-2-3-5-7;1-2-7-3-5-8-6-4-7;1-2-6-5-7-3-4-8-5;1-5-6-3-4-7(5)2;1-6-2-4-7-5-3-6;2*1-4(5)6(2)3;1-4-5(2)3;1-3(4)5-6-2;1-3(4)5-2;1-2(3)4-5;1-2(3)4/h3-6H,7-9H2,1-2H3,(H,13,14);2-3,6-7H,4-5,8-10H2,1H3;2-5H,6-8H2,1H3,(H2,12,13,14);4-7,11H,1-3H3;2*4-7H,8H2,1-3H3;2*7,9H,3-6H2,1-2H3;2-5H,1H3,(H3,9,10);2*2-5H,1H3,(H2,9,10);2*2-5H,6,9H2,1H3;3-6H,1-2H3;6H,2-5H2,1H3,(H3,8,9);2-4H,1H3,(H2,8,10);3-6H2,1-2H3;3-7H2,1-2H3;2-5H,1H3,(H2,8,9,10);2-5H2,1H3,(H3,7,8);3-5H2,1-2H3;7H,2-6H2,1H3;2-4H,1H3,(H2,7,8);7H,2-5H2,1H3;2-4H,1H3,(H,7,8);2-5H2,1H3;2-6H2,1H3;2-4H2,1H3,(H,6,7);3-4H2,1-2H3;2-5H2,1H3;2*5H,1-3H3;4H2,1-3H3;1-2H3,(H2,4,5);1-2H3,(H2,4,5);5H,1H3,(H2,3,4);1H3,(H3,3,4)/b;;;11-10-;;;2*9-8+;;;;;;;;;8-7+;;;;;;;7-6+;;;;;;;2*5-4+;;;;;
InChIKeyRTIPRAOTPKZCCN-MFHJLTARSA-N
XLogP29.96
TPSA1110.27 Ų
H-Bond Donors31
H-Bond Acceptors57
Rotatable Bonds25
Heavy Atoms330
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004622.73
LogP ≤ 529.96
H-Bond Donors ≤ 531
H-Bond Acceptors ≤ 1057

Analyze 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide with MolForge

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What is the IUPAC name of 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide?
The IUPAC name of 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide (CID 160722989) is 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide.
What is the SMILES notation for 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide?
The canonical SMILES for 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide is C/N=C(\C)N.C/N=C(\C)N1CCCC1.CC(=O)N1CCCC1.CC(N)=NO.CC1=NCCN1C.CCN(C)C.CCN(C)C1=NCCO1.CCN1CCN(C)CC1.CCN1CCOCC1.CCNC1=NCCO1.CN1CCCNCC1.CN1CCOCC1.CON=C(C)N.Cc1cc[nH]c(=O)c1.Cc1cccc(C(N)=O)c1.Cc1cccc(CN(C)C)c1.Cc1cccc(CN)c1.Cc1ccccc1C(N)=O.Cc1ccccc1CN.Cc1ccccc1CN(C)C.Cc1ccccc1CN1CCCC1.Cc1ccccc1CNC1=NCCN1.Cc1ccccc1CNC1=NCCN1C.Cc1ccccc1S(C)(=O)=O.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(C(N)=O)c1.Cc1ccnc(N)c1.[H]/N=C(/c1ccccc1C)N(C)C.[H]/N=C(\C)N.[H]/N=C(\C)N(C)C.[H]/N=C(\C)N(C)C.[H]/N=C(\C)N1CCC(C)CC1.[H]/N=C(\C)N1CCC(C)CC1.[H]/N=C(\C)N1CCCC1.[H]/N=C(\N)N1CCC(C)CC1.[H]/N=C(\N)N1CCN(C)CC1.[H]/N=C(\N)c1ccccc1C.
What is the InChIKey of 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide?
The InChIKey is RTIPRAOTPKZCCN-MFHJLTARSA-N. The full InChI is InChI=1S/C12H17N3.C12H17N.C11H15N3.C10H14N2.2C10H15N.2C8H16N2.C8H10N2.2C8H9NO.2C8H11N.C8H10O2S.C7H15N3.C7H8N2O.C7H14N2.C7H16N2.C7H9NO2S.C6H14N4.C6H12N2O.C6H14N2.C6H8N2.C6H12N2.C6H7NO.C6H11NO.C6H13NO.C5H10N2O.C5H10N2.C5H11NO.2C4H10N2.C4H11N.C3H8N2O.C3H8N2.C2H6N2O.C2H6N2/c1-10-5-3-4-6-11(10)9-14-12-13-7-8-15(12)2;1-11-6-2-3-7-12(11)10-13-8-4-5-9-13;1-9-4-2-3-5-10(9)8-14-11-12-6-7-13-11;1-8-6-4-5-7-9(8)10(11)12(2)3;1-9-5-4-6-10(7-9)8-11(2)3;1-9-6-4-5-7-10(9)8-11(2)3;2*1-7-3-5-10(6-4-7)8(2)9;1-6-4-2-3-5-7(6)8(9)10;1-6-3-2-4-7(5-6)8(9)10;1-6-4-2-3-5-7(6)8(9)10;1-7-3-2-4-8(5-7)6-9;1-7-4-2-3-5-8(7)6-9;1-7-5-3-4-6-8(7)11(2,9)10;1-6-2-4-10(5-3-6)7(8)9;1-5-2-3-9-6(4-5)7(8)10;1-7(8-2)9-5-3-4-6-9;1-3-9-6-4-8(2)5-7-9;1-6-4-2-3-5-7(6)11(8,9)10;1-9-2-4-10(5-3-9)6(7)8;1-3-8(2)6-7-4-5-9-6;1-8-5-2-3-7-4-6-8;1-5-2-3-8-6(7)4-5;1-6(7)8-4-2-3-5-8;1-5-2-3-7-6(8)4-5;1-6(8)7-4-2-3-5-7;1-2-7-3-5-8-6-4-7;1-2-6-5-7-3-4-8-5;1-5-6-3-4-7(5)2;1-6-2-4-7-5-3-6;2*1-4(5)6(2)3;1-4-5(2)3;1-3(4)5-6-2;1-3(4)5-2;1-2(3)4-5;1-2(3)4/h3-6H,7-9H2,1-2H3,(H,13,14);2-3,6-7H,4-5,8-10H2,1H3;2-5H,6-8H2,1H3,(H2,12,13,14);4-7,11H,1-3H3;2*4-7H,8H2,1-3H3;2*7,9H,3-6H2,1-2H3;2-5H,1H3,(H3,9,10);2*2-5H,1H3,(H2,9,10);2*2-5H,6,9H2,1H3;3-6H,1-2H3;6H,2-5H2,1H3,(H3,8,9);2-4H,1H3,(H2,8,10);3-6H2,1-2H3;3-7H2,1-2H3;2-5H,1H3,(H2,8,9,10);2-5H2,1H3,(H3,7,8);3-5H2,1-2H3;7H,2-6H2,1H3;2-4H,1H3,(H2,7,8);7H,2-5H2,1H3;2-4H,1H3,(H,7,8);2-5H2,1H3;2-6H2,1H3;2-4H2,1H3,(H,6,7);3-4H2,1-2H3;2-5H2,1H3;2*5H,1-3H3;4H2,1-3H3;1-2H3,(H2,4,5);1-2H3,(H2,4,5);5H,1H3,(H2,3,4);1H3,(H3,3,4)/b;;;11-10-;;;2*9-8+;;;;;;;;;8-7+;;;;;;;7-6+;;;;;;;2*5-4+;;;;;.
What are the key properties of 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide?
1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide has a molecular weight of 4622.73 g/mol, XLogP of 29.96, 25 rotatable bonds, 31 hydrogen bond donors, and 57 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;bis(N,N-dimethylethanimidamide);N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;N-ethyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpiperazine-1-carboximidamide;4-methylpiperidine-1-carboximidamide;bis(1-(4-methylpiperidin-1-yl)ethanimine);4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide is sourced from PubChem (CID 160722989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).