N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide

C271H368FN63O22S2 — CID 159267702

IUPACN-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide
SMILESCCC(C)N(C)C(=O)c1cccc(NC)c1.CCC(C)NC(=O)c1cccc(NC)c1.CNC(=O)c1cc(C)cc(NC)c1.CNC(=O)c1cccc(NC)c1.CNC(=O)c1cccc(NC)c1.CNc1cc(C(=O)N(C)C)cc(C)n1.CNc1cc(C(=O)N2CCCC2)cc(C)n1.CNc1cc(C(=O)N2CCCC2)ccn1.CNc1cc(C(=O)N2CCOCC2)cc(C)n1.CNc1cc(C(C)(C)C)on1.CNc1cc(C2CC2)nn1C.CNc1cccc(-c2ccn[nH]2)c1.CNc1cccc(-c2cscn2)c1.CNc1cccc(-c2cscn2)c1.CNc1cccc(-c2noc(NC)n2)c1.CNc1cccc(-c2noc(NC)n2)c1.CNc1cccc(C(=O)N(C)C(C)C)c1.CNc1cccc(C(=O)N(C)C)c1.CNc1cccc(C(=O)N(C)C2CC2)c1.CNc1cccc(C(=O)N2CCCC2)c1.CNc1cccc(C(=O)NC2CCC2)c1.CNc1cccc(C(=O)NCC(C)C)c1.CNc1cccc(C(=O)NCC(C)F)c1.CNc1cccc(C(=O)NCC2CC2)c1.CNc1cccc(C2N=CN=N2)c1.CNc1ccoc1
InChIInChI=1S/C13H20N2O.C12H17N3O2.C12H17N3O.4C12H16N2O.3C12H18N2O.C11H15FN2O.C11H15N3O.2C10H12N4O.C10H15N3O.C10H11N3.2C10H14N2O.2C10H10N2S.C9H10N4.2C9H12N2O.C8H13N3.C8H14N2O.C5H7NO/c1-5-10(2)15(4)13(16)11-7-6-8-12(9-11)14-3;1-9-7-10(8-11(13-2)14-9)12(16)15-3-5-17-6-4-15;1-9-7-10(8-11(13-2)14-9)12(16)15-5-3-4-6-15;1-13-10-5-3-4-9(8-10)12(15)14(2)11-6-7-11;1-13-11-7-2-4-9(8-11)12(15)14-10-5-3-6-10;1-13-11-6-4-5-10(9-11)12(15)14-7-2-3-8-14;1-13-11-4-2-3-10(7-11)12(15)14-8-9-5-6-9;1-9(2)14(4)12(15)10-6-5-7-11(8-10)13-3;1-9(2)8-14-12(15)10-5-4-6-11(7-10)13-3;1-4-9(2)14-12(15)10-6-5-7-11(8-10)13-3;1-8(12)7-14-11(15)9-4-3-5-10(6-9)13-2;1-12-10-8-9(4-5-13-10)11(15)14-6-2-3-7-14;2*1-11-8-5-3-4-7(6-8)9-13-10(12-2)15-14-9;1-7-5-8(10(14)13(3)4)6-9(11-2)12-7;1-11-9-4-2-3-8(7-9)10-5-6-12-13-10;1-7-4-8(10(13)12-3)6-9(5-7)11-2;1-11-9-6-4-5-8(7-9)10(13)12(2)3;2*1-11-9-4-2-3-8(5-9)10-6-13-7-12-10;1-10-8-4-2-3-7(5-8)9-11-6-12-13-9;2*1-10-8-5-3-4-7(6-8)9(12)11-2;1-9-8-5-7(6-3-4-6)10-11(8)2;1-8(2,3)6-5-7(9-4)10-11-6;1-6-5-2-3-7-4-5/h6-10,14H,5H2,1-4H3;7-8H,3-6H2,1-2H3,(H,13,14);7-8H,3-6H2,1-2H3,(H,13,14);3-5,8,11,13H,6-7H2,1-2H3;2,4,7-8,10,13H,3,5-6H2,1H3,(H,14,15);4-6,9,13H,2-3,7-8H2,1H3;2-4,7,9,13H,5-6,8H2,1H3,(H,14,15);5-9,13H,1-4H3;4-7,9,13H,8H2,1-3H3,(H,14,15);5-9,13H,4H2,1-3H3,(H,14,15);3-6,8,13H,7H2,1-2H3,(H,14,15);4-5,8H,2-3,6-7H2,1H3,(H,12,13);2*3-6,11H,1-2H3,(H,12,13,14);5-6H,1-4H3,(H,11,12);2-7,11H,1H3,(H,12,13);4-6,11H,1-3H3,(H,12,13);4-7,11H,1-3H3;2*2-7,11H,1H3;2-6,9-10H,1H3;2*3-6,10H,1-2H3,(H,11,12);5-6,9H,3-4H2,1-2H3;5H,1-4H3,(H,9,10);2-4,6H,1H3
InChIKeyKXHVAQCZWMLWMP-UHFFFAOYSA-N
MW4943.48 g/mol
LogP47.22
Rot. Bonds65

About N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide

N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide (PubChem CID 159267702) has the molecular formula C271H368FN63O22S2 and a molecular weight of 4943.48 g/mol. Its IUPAC name is N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide
PubChem CID159267702
Molecular FormulaC271H368FN63O22S2
Molecular Weight4943.48 g/mol
Exact Mass4939.90
IUPAC NameN-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide
SMILESCCC(C)N(C)C(=O)c1cccc(NC)c1.CCC(C)NC(=O)c1cccc(NC)c1.CNC(=O)c1cc(C)cc(NC)c1.CNC(=O)c1cccc(NC)c1.CNC(=O)c1cccc(NC)c1.CNc1cc(C(=O)N(C)C)cc(C)n1.CNc1cc(C(=O)N2CCCC2)cc(C)n1.CNc1cc(C(=O)N2CCCC2)ccn1.CNc1cc(C(=O)N2CCOCC2)cc(C)n1.CNc1cc(C(C)(C)C)on1.CNc1cc(C2CC2)nn1C.CNc1cccc(-c2ccn[nH]2)c1.CNc1cccc(-c2cscn2)c1.CNc1cccc(-c2cscn2)c1.CNc1cccc(-c2noc(NC)n2)c1.CNc1cccc(-c2noc(NC)n2)c1.CNc1cccc(C(=O)N(C)C(C)C)c1.CNc1cccc(C(=O)N(C)C)c1.CNc1cccc(C(=O)N(C)C2CC2)c1.CNc1cccc(C(=O)N2CCCC2)c1.CNc1cccc(C(=O)NC2CCC2)c1.CNc1cccc(C(=O)NCC(C)C)c1.CNc1cccc(C(=O)NCC(C)F)c1.CNc1cccc(C(=O)NCC2CC2)c1.CNc1cccc(C2N=CN=N2)c1.CNc1ccoc1
InChIInChI=1S/C13H20N2O.C12H17N3O2.C12H17N3O.4C12H16N2O.3C12H18N2O.C11H15FN2O.C11H15N3O.2C10H12N4O.C10H15N3O.C10H11N3.2C10H14N2O.2C10H10N2S.C9H10N4.2C9H12N2O.C8H13N3.C8H14N2O.C5H7NO/c1-5-10(2)15(4)13(16)11-7-6-8-12(9-11)14-3;1-9-7-10(8-11(13-2)14-9)12(16)15-3-5-17-6-4-15;1-9-7-10(8-11(13-2)14-9)12(16)15-5-3-4-6-15;1-13-10-5-3-4-9(8-10)12(15)14(2)11-6-7-11;1-13-11-7-2-4-9(8-11)12(15)14-10-5-3-6-10;1-13-11-6-4-5-10(9-11)12(15)14-7-2-3-8-14;1-13-11-4-2-3-10(7-11)12(15)14-8-9-5-6-9;1-9(2)14(4)12(15)10-6-5-7-11(8-10)13-3;1-9(2)8-14-12(15)10-5-4-6-11(7-10)13-3;1-4-9(2)14-12(15)10-6-5-7-11(8-10)13-3;1-8(12)7-14-11(15)9-4-3-5-10(6-9)13-2;1-12-10-8-9(4-5-13-10)11(15)14-6-2-3-7-14;2*1-11-8-5-3-4-7(6-8)9-13-10(12-2)15-14-9;1-7-5-8(10(14)13(3)4)6-9(11-2)12-7;1-11-9-4-2-3-8(7-9)10-5-6-12-13-10;1-7-4-8(10(13)12-3)6-9(5-7)11-2;1-11-9-6-4-5-8(7-9)10(13)12(2)3;2*1-11-9-4-2-3-8(5-9)10-6-13-7-12-10;1-10-8-4-2-3-7(5-8)9-11-6-12-13-9;2*1-10-8-5-3-4-7(6-8)9(12)11-2;1-9-8-5-7(6-3-4-6)10-11(8)2;1-8(2,3)6-5-7(9-4)10-11-6;1-6-5-2-3-7-4-5/h6-10,14H,5H2,1-4H3;7-8H,3-6H2,1-2H3,(H,13,14);7-8H,3-6H2,1-2H3,(H,13,14);3-5,8,11,13H,6-7H2,1-2H3;2,4,7-8,10,13H,3,5-6H2,1H3,(H,14,15);4-6,9,13H,2-3,7-8H2,1H3;2-4,7,9,13H,5-6,8H2,1H3,(H,14,15);5-9,13H,1-4H3;4-7,9,13H,8H2,1-3H3,(H,14,15);5-9,13H,4H2,1-3H3,(H,14,15);3-6,8,13H,7H2,1-2H3,(H,14,15);4-5,8H,2-3,6-7H2,1H3,(H,12,13);2*3-6,11H,1-2H3,(H,12,13,14);5-6H,1-4H3,(H,11,12);2-7,11H,1H3,(H,12,13);4-6,11H,1-3H3,(H,12,13);4-7,11H,1-3H3;2*2-7,11H,1H3;2-6,9-10H,1H3;2*3-6,10H,1-2H3,(H,11,12);5-6,9H,3-4H2,1-2H3;5H,1-4H3,(H,9,10);2-4,6H,1H3
InChIKeyKXHVAQCZWMLWMP-UHFFFAOYSA-N
XLogP47.22
TPSA1039.59 Ų
H-Bond Donors37
H-Bond Acceptors69
Rotatable Bonds65
Heavy Atoms359
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004943.48
LogP ≤ 547.22
H-Bond Donors ≤ 537
H-Bond Acceptors ≤ 1069

Analyze N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide?
The IUPAC name of N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide (CID 159267702) is N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide is CCC(C)N(C)C(=O)c1cccc(NC)c1.CCC(C)NC(=O)c1cccc(NC)c1.CNC(=O)c1cc(C)cc(NC)c1.CNC(=O)c1cccc(NC)c1.CNC(=O)c1cccc(NC)c1.CNc1cc(C(=O)N(C)C)cc(C)n1.CNc1cc(C(=O)N2CCCC2)cc(C)n1.CNc1cc(C(=O)N2CCCC2)ccn1.CNc1cc(C(=O)N2CCOCC2)cc(C)n1.CNc1cc(C(C)(C)C)on1.CNc1cc(C2CC2)nn1C.CNc1cccc(-c2ccn[nH]2)c1.CNc1cccc(-c2cscn2)c1.CNc1cccc(-c2cscn2)c1.CNc1cccc(-c2noc(NC)n2)c1.CNc1cccc(-c2noc(NC)n2)c1.CNc1cccc(C(=O)N(C)C(C)C)c1.CNc1cccc(C(=O)N(C)C)c1.CNc1cccc(C(=O)N(C)C2CC2)c1.CNc1cccc(C(=O)N2CCCC2)c1.CNc1cccc(C(=O)NC2CCC2)c1.CNc1cccc(C(=O)NCC(C)C)c1.CNc1cccc(C(=O)NCC(C)F)c1.CNc1cccc(C(=O)NCC2CC2)c1.CNc1cccc(C2N=CN=N2)c1.CNc1ccoc1.
What is the InChIKey of N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide?
The InChIKey is KXHVAQCZWMLWMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O.C12H17N3O2.C12H17N3O.4C12H16N2O.3C12H18N2O.C11H15FN2O.C11H15N3O.2C10H12N4O.C10H15N3O.C10H11N3.2C10H14N2O.2C10H10N2S.C9H10N4.2C9H12N2O.C8H13N3.C8H14N2O.C5H7NO/c1-5-10(2)15(4)13(16)11-7-6-8-12(9-11)14-3;1-9-7-10(8-11(13-2)14-9)12(16)15-3-5-17-6-4-15;1-9-7-10(8-11(13-2)14-9)12(16)15-5-3-4-6-15;1-13-10-5-3-4-9(8-10)12(15)14(2)11-6-7-11;1-13-11-7-2-4-9(8-11)12(15)14-10-5-3-6-10;1-13-11-6-4-5-10(9-11)12(15)14-7-2-3-8-14;1-13-11-4-2-3-10(7-11)12(15)14-8-9-5-6-9;1-9(2)14(4)12(15)10-6-5-7-11(8-10)13-3;1-9(2)8-14-12(15)10-5-4-6-11(7-10)13-3;1-4-9(2)14-12(15)10-6-5-7-11(8-10)13-3;1-8(12)7-14-11(15)9-4-3-5-10(6-9)13-2;1-12-10-8-9(4-5-13-10)11(15)14-6-2-3-7-14;2*1-11-8-5-3-4-7(6-8)9-13-10(12-2)15-14-9;1-7-5-8(10(14)13(3)4)6-9(11-2)12-7;1-11-9-4-2-3-8(7-9)10-5-6-12-13-10;1-7-4-8(10(13)12-3)6-9(5-7)11-2;1-11-9-6-4-5-8(7-9)10(13)12(2)3;2*1-11-9-4-2-3-8(5-9)10-6-13-7-12-10;1-10-8-4-2-3-7(5-8)9-11-6-12-13-9;2*1-10-8-5-3-4-7(6-8)9(12)11-2;1-9-8-5-7(6-3-4-6)10-11(8)2;1-8(2,3)6-5-7(9-4)10-11-6;1-6-5-2-3-7-4-5/h6-10,14H,5H2,1-4H3;7-8H,3-6H2,1-2H3,(H,13,14);7-8H,3-6H2,1-2H3,(H,13,14);3-5,8,11,13H,6-7H2,1-2H3;2,4,7-8,10,13H,3,5-6H2,1H3,(H,14,15);4-6,9,13H,2-3,7-8H2,1H3;2-4,7,9,13H,5-6,8H2,1H3,(H,14,15);5-9,13H,1-4H3;4-7,9,13H,8H2,1-3H3,(H,14,15);5-9,13H,4H2,1-3H3,(H,14,15);3-6,8,13H,7H2,1-2H3,(H,14,15);4-5,8H,2-3,6-7H2,1H3,(H,12,13);2*3-6,11H,1-2H3,(H,12,13,14);5-6H,1-4H3,(H,11,12);2-7,11H,1H3,(H,12,13);4-6,11H,1-3H3,(H,12,13);4-7,11H,1-3H3;2*2-7,11H,1H3;2-6,9-10H,1H3;2*3-6,10H,1-2H3,(H,11,12);5-6,9H,3-4H2,1-2H3;5H,1-4H3,(H,9,10);2-4,6H,1H3.
What are the key properties of N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide?
N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide has a molecular weight of 4943.48 g/mol, XLogP of 47.22, 65 rotatable bonds, 37 hydrogen bond donors, and 69 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3-(methylamino)benzamide;N-butan-2-yl-N-methyl-3-(methylamino)benzamide;5-tert-butyl-N-methyl-1,2-oxazol-3-amine;N-cyclobutyl-3-(methylamino)benzamide;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-cyclopropyl-N-methyl-3-(methylamino)benzamide;N-(cyclopropylmethyl)-3-(methylamino)benzamide;N,N-dimethyl-3-(methylamino)benzamide;N,3-dimethyl-5-(methylamino)benzamide;N-(2-fluoropropyl)-3-(methylamino)benzamide;3-(methylamino)-N-(2-methylpropyl)benzamide;[3-(methylamino)phenyl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);bis(N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine);N-methyl-3-(methylamino)-N-propan-2-ylbenzamide;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;bis(N-methyl-3-(1,3-thiazol-4-yl)aniline);N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 159267702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).