ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene

C202H320N38O10S — CID 157312794

IUPACethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene
SMILESC/N=C(\C)N.C=C(C)N1CCCC1.CC(=O)N1CCCC1.CC(N)=NO.CC1=NCCC1.CCC.CCN1CCCCC1.CCN1CCOCC1.CCc1ccccc1C.CN1CCCNCC1.CN1CCOCC1.Cc1cc[nH]c(=O)c1.Cc1cccc(C(N)=O)c1.Cc1cccc(C)c1.Cc1cccc(CN)c1.Cc1ccccc1C.Cc1ccccc1C(N)=O.Cc1ccccc1CN.Cc1ccccc1CN1CCCC1.Cc1ccccc1CNC1=NCCC1.Cc1ccccc1CNC1=NCCN1.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(C(N)=O)c1.Cc1ccnc(N)c1.[H]/N=C(\C)N.[H]/N=C(\C)N1CCCC1.[H]/N=C(\C)c1ccccc1C.[H]/N=C(\N)c1ccccc1C.[H]N=C(C)C.[H]N=C(C)C.[H]N=C(C)C
InChIInChI=1S/C12H16N2.C12H17N.C11H15N3.C9H11N.C9H12.C8H10N2.2C8H9NO.2C8H11N.2C8H10.C7H8N2O.C7H9NO2S.C7H13N.C7H15N.C6H14N2.C6H8N2.C6H12N2.C6H7NO.C6H11NO.C6H13NO.C5H11NO.C5H9N.C3H8N2.3C3H7N.C3H8.C2H6N2O.C2H6N2/c1-10-5-2-3-6-11(10)9-14-12-7-4-8-13-12;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;1-7-5-3-4-6-9(7)8(2)10;1-3-9-7-5-4-6-8(9)2;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;1-7-4-3-5-8(2)6-7;1-7-5-3-4-6-8(7)2;1-5-2-3-9-6(4-5)7(8)10;1-6-4-2-3-5-7(6)11(8,9)10;1-7(2)8-5-3-4-6-8;1-2-8-6-4-3-5-7-8;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;1-6-2-4-7-5-3-6;1-5-3-2-4-6-5;1-3(4)5-2;3*1-3(2)4;1-3-2;1-2(3)4-5;1-2(3)4/h2-3,5-6H,4,7-9H2,1H3,(H,13,14);2-3,6-7H,4-5,8-10H2,1H3;2-5H,6-8H2,1H3,(H2,12,13,14);3-6,10H,1-2H3;4-7H,3H2,1-2H3;2-5H,1H3,(H3,9,10);2*2-5H,1H3,(H2,9,10);2*2-5H,6,9H2,1H3;2*3-6H,1-2H3;2-4H,1H3,(H2,8,10);2-5H,1H3,(H2,8,9,10);1,3-6H2,2H3;2-7H2,1H3;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;2-5H2,1H3;2-4H2,1H3;1-2H3,(H2,4,5);3*4H,1-2H3;3H2,1-2H3;5H,1H3,(H2,3,4);1H3,(H3,3,4)/b;;;10-8+;;;;;;;;;;;;;;;7-6+;;;;;;;;;;;;
InChIKeyBDFUFLCWVZMVIV-SXRDKQLXSA-N
MW3473.10 g/mol
LogP35.12
Rot. Bonds18

About ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene

ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene (PubChem CID 157312794) has the molecular formula C202H320N38O10S and a molecular weight of 3473.10 g/mol. Its IUPAC name is ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene.

Molecular Properties

Compound Nameethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene
PubChem CID157312794
Molecular FormulaC202H320N38O10S
Molecular Weight3473.10 g/mol
Exact Mass3470.54
IUPAC Nameethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene
SMILESC/N=C(\C)N.C=C(C)N1CCCC1.CC(=O)N1CCCC1.CC(N)=NO.CC1=NCCC1.CCC.CCN1CCCCC1.CCN1CCOCC1.CCc1ccccc1C.CN1CCCNCC1.CN1CCOCC1.Cc1cc[nH]c(=O)c1.Cc1cccc(C(N)=O)c1.Cc1cccc(C)c1.Cc1cccc(CN)c1.Cc1ccccc1C.Cc1ccccc1C(N)=O.Cc1ccccc1CN.Cc1ccccc1CN1CCCC1.Cc1ccccc1CNC1=NCCC1.Cc1ccccc1CNC1=NCCN1.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(C(N)=O)c1.Cc1ccnc(N)c1.[H]/N=C(\C)N.[H]/N=C(\C)N1CCCC1.[H]/N=C(\C)c1ccccc1C.[H]/N=C(\N)c1ccccc1C.[H]N=C(C)C.[H]N=C(C)C.[H]N=C(C)C
InChIInChI=1S/C12H16N2.C12H17N.C11H15N3.C9H11N.C9H12.C8H10N2.2C8H9NO.2C8H11N.2C8H10.C7H8N2O.C7H9NO2S.C7H13N.C7H15N.C6H14N2.C6H8N2.C6H12N2.C6H7NO.C6H11NO.C6H13NO.C5H11NO.C5H9N.C3H8N2.3C3H7N.C3H8.C2H6N2O.C2H6N2/c1-10-5-2-3-6-11(10)9-14-12-7-4-8-13-12;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;1-7-5-3-4-6-9(7)8(2)10;1-3-9-7-5-4-6-8(9)2;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;1-7-4-3-5-8(2)6-7;1-7-5-3-4-6-8(7)2;1-5-2-3-9-6(4-5)7(8)10;1-6-4-2-3-5-7(6)11(8,9)10;1-7(2)8-5-3-4-6-8;1-2-8-6-4-3-5-7-8;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;1-6-2-4-7-5-3-6;1-5-3-2-4-6-5;1-3(4)5-2;3*1-3(2)4;1-3-2;1-2(3)4-5;1-2(3)4/h2-3,5-6H,4,7-9H2,1H3,(H,13,14);2-3,6-7H,4-5,8-10H2,1H3;2-5H,6-8H2,1H3,(H2,12,13,14);3-6,10H,1-2H3;4-7H,3H2,1-2H3;2-5H,1H3,(H3,9,10);2*2-5H,1H3,(H2,9,10);2*2-5H,6,9H2,1H3;2*3-6H,1-2H3;2-4H,1H3,(H2,8,10);2-5H,1H3,(H2,8,9,10);1,3-6H2,2H3;2-7H2,1H3;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;2-5H2,1H3;2-4H2,1H3;1-2H3,(H2,4,5);3*4H,1-2H3;3H2,1-2H3;5H,1H3,(H2,3,4);1H3,(H3,3,4)/b;;;10-8+;;;;;;;;;;;;;;;7-6+;;;;;;;;;;;;
InChIKeyBDFUFLCWVZMVIV-SXRDKQLXSA-N
XLogP35.12
TPSA788.76 Ų
H-Bond Donors24
H-Bond Acceptors37
Rotatable Bonds18
Heavy Atoms251
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003473.10
LogP ≤ 535.12
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene with MolForge

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Related Compounds

1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;N,N-dimethylethanimidamide;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;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-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-trimethylaniline;N,N,2-trimethylbenzenecarboximidamide;N,N,N'-trimethylethanimidamide
CID 157377296
N,N-dimethylethanimidamide;N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;1-pyrrolidin-1-ylethanimine;N,N,2-trimethylbenzenecarboximidamide
CID 157522574
1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;N-methylpropan-2-imine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;bis(propan-2-imine);1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide
CID 159296047
CID 159488400
CID 159488400
1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;1-methyl-2-methylsulfonylbenzene;4-methylmorpholine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;bis(N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine);1-[(2-methylphenyl)methyl]pyrrolidine;N-methylpropan-2-imine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;propane;bis(propan-2-imine);1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylbenzenecarboximidamide
CID 160132407
CID 160140004
CID 160140004
1,2-dimethyl-4,5-dihydroimidazole;N,N'-dimethylethanimidamide;N,N-dimethylethanimidamide;N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;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 160244104
N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;bis(propan-2-imine);1-pyrrolidin-1-ylethanimine;N,N,2-trimethylbenzenecarboximidamide
CID 160415274
CID 160722989
CID 160722989
4-benzylmorpholine;2,4-dimethylpyridine;3,4-dimethylpyridine;2,4-dimethylpyrimidine;1-ethyl-2-methylbenzene;4-fluoro-1,2-dimethylbenzene;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;2-methylbenzonitrile;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;1-[(2-methylphenyl)methyl]piperidine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine;4-methylpyridine-2-carbonitrile;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;(4-methyl-2-pyridinyl)methanamine;4-methylpyrimidin-2-amine;6-methylpyrimidin-4-amine;(4-methylpyrimidin-2-yl)methanamine;(6-methylpyrimidin-4-yl)methanamine;bis(1,2-xylene);1,3-xylene
CID 161199801
1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;N,N-dimethylethanimidamide;N,N-dimethyl-1-(2-methylphenyl)methanamine;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;1-ethyl-4-methylpiperazine;4-ethylmorpholine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;N'-methylethanimidamide;1-methyl-N-[(2-methylphenyl)methyl]-4,5-dihydroimidazol-2-amine;1-methyl-2-methylsulfonylbenzene;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;1-[(2-methylphenyl)methyl]pyrrolidine;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;N,N,N'-trimethylethanimidamide
CID 161510069
1,2-dimethyl-4,5-dihydroimidazole;N,N-dimethylethanamine;N,N-dimethylethanimidamide;N,N-dimethyl-1-(3-methylphenyl)methanamine;ethanimidamide;1-ethyl-4-methylpiperazine;N'-hydroxyethanimidamide;N'-methoxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;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-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;N-methyl-1-pyrrolidin-1-ylethanimine;morpholine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;N,N,2-trimethylaniline;N,N,2-trimethylbenzenecarboximidamide;N,N,N'-trimethylethanimidamide
CID 161551396

Frequently Asked Questions

What is the IUPAC name of ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene?
The IUPAC name of ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene (CID 157312794) is ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene.
What is the SMILES notation for ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene?
The canonical SMILES for ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene is C/N=C(\C)N.C=C(C)N1CCCC1.CC(=O)N1CCCC1.CC(N)=NO.CC1=NCCC1.CCC.CCN1CCCCC1.CCN1CCOCC1.CCc1ccccc1C.CN1CCCNCC1.CN1CCOCC1.Cc1cc[nH]c(=O)c1.Cc1cccc(C(N)=O)c1.Cc1cccc(C)c1.Cc1cccc(CN)c1.Cc1ccccc1C.Cc1ccccc1C(N)=O.Cc1ccccc1CN.Cc1ccccc1CN1CCCC1.Cc1ccccc1CNC1=NCCC1.Cc1ccccc1CNC1=NCCN1.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(C(N)=O)c1.Cc1ccnc(N)c1.[H]/N=C(\C)N.[H]/N=C(\C)N1CCCC1.[H]/N=C(\C)c1ccccc1C.[H]/N=C(\N)c1ccccc1C.[H]N=C(C)C.[H]N=C(C)C.[H]N=C(C)C.
What is the InChIKey of ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene?
The InChIKey is BDFUFLCWVZMVIV-SXRDKQLXSA-N. The full InChI is InChI=1S/C12H16N2.C12H17N.C11H15N3.C9H11N.C9H12.C8H10N2.2C8H9NO.2C8H11N.2C8H10.C7H8N2O.C7H9NO2S.C7H13N.C7H15N.C6H14N2.C6H8N2.C6H12N2.C6H7NO.C6H11NO.C6H13NO.C5H11NO.C5H9N.C3H8N2.3C3H7N.C3H8.C2H6N2O.C2H6N2/c1-10-5-2-3-6-11(10)9-14-12-7-4-8-13-12;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;1-7-5-3-4-6-9(7)8(2)10;1-3-9-7-5-4-6-8(9)2;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;1-7-4-3-5-8(2)6-7;1-7-5-3-4-6-8(7)2;1-5-2-3-9-6(4-5)7(8)10;1-6-4-2-3-5-7(6)11(8,9)10;1-7(2)8-5-3-4-6-8;1-2-8-6-4-3-5-7-8;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;1-6-2-4-7-5-3-6;1-5-3-2-4-6-5;1-3(4)5-2;3*1-3(2)4;1-3-2;1-2(3)4-5;1-2(3)4/h2-3,5-6H,4,7-9H2,1H3,(H,13,14);2-3,6-7H,4-5,8-10H2,1H3;2-5H,6-8H2,1H3,(H2,12,13,14);3-6,10H,1-2H3;4-7H,3H2,1-2H3;2-5H,1H3,(H3,9,10);2*2-5H,1H3,(H2,9,10);2*2-5H,6,9H2,1H3;2*3-6H,1-2H3;2-4H,1H3,(H2,8,10);2-5H,1H3,(H2,8,9,10);1,3-6H2,2H3;2-7H2,1H3;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;2-5H2,1H3;2-4H2,1H3;1-2H3,(H2,4,5);3*4H,1-2H3;3H2,1-2H3;5H,1H3,(H2,3,4);1H3,(H3,3,4)/b;;;10-8+;;;;;;;;;;;;;;;7-6+;;;;;;;;;;;;.
What are the key properties of ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene?
ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene has a molecular weight of 3473.10 g/mol, XLogP of 35.12, 18 rotatable bonds, 24 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for ethanimidamide;1-ethyl-2-methylbenzene;4-ethylmorpholine;1-ethylpiperidine;N'-hydroxyethanimidamide;2-methylbenzamide;3-methylbenzamide;2-methylbenzenecarboximidamide;2-methylbenzenesulfonamide;1-methyl-1,4-diazepane;5-methyl-3,4-dihydro-2H-pyrrole;N'-methylethanimidamide;4-methylmorpholine;1-(2-methylphenyl)ethanimine;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;N-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine;1-[(2-methylphenyl)methyl]pyrrolidine;4-methylpyridin-2-amine;4-methylpyridine-2-carboxamide;4-methyl-1H-pyridin-2-one;propane;tris(propan-2-imine);1-prop-1-en-2-ylpyrrolidine;1-pyrrolidin-1-ylethanimine;1-pyrrolidin-1-ylethanone;1,2-xylene;1,3-xylene is sourced from PubChem (CID 157312794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).