3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide

C134H141N25O15 — CID 157268733

IUPAC3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide
SMILESCNC(=O)c1cc(Cc2nc3ccccc3n2CCOC)cc2ccccc12.CNC(=O)c1cccc(N(CCOC)C2=Nc3ccccc3C2)c1.CNC(=O)c1cccc(NC2=Nc3cc(C)c(C)cc3C2)c1.CNC(=O)c1cccc(Nc2nc3c(OC)cccc3n2CCOC)c1.CNC(=O)c1cccc(Nc2nc3cccc(OC)c3n2CCOC)c1.CNC(=O)c1cccc(Nc2nc3ccccc3n2CCOC)c1.O=C(NO)c1cc(Nc2nc3ccccc3[nH]2)cc2ccccc12
InChIInChI=1S/C23H23N3O2.2C19H22N4O3.C19H21N3O2.C18H14N4O2.C18H20N4O2.C18H19N3O/c1-24-23(27)19-14-16(13-17-7-3-4-8-18(17)19)15-22-25-20-9-5-6-10-21(20)26(22)11-12-28-2;1-20-18(24)13-6-4-7-14(12-13)21-19-22-17-15(23(19)10-11-25-2)8-5-9-16(17)26-3;1-20-18(24)13-6-4-7-14(12-13)21-19-22-15-8-5-9-16(26-3)17(15)23(19)10-11-25-2;1-20-19(23)15-7-5-8-16(12-15)22(10-11-24-2)18-13-14-6-3-4-9-17(14)21-18;23-17(22-24)14-10-12(9-11-5-1-2-6-13(11)14)19-18-20-15-7-3-4-8-16(15)21-18;1-19-17(23)13-6-5-7-14(12-13)20-18-21-15-8-3-4-9-16(15)22(18)10-11-24-2;1-11-7-14-10-17(21-16(14)8-12(11)2)20-15-6-4-5-13(9-15)18(22)19-3/h3-10,13-14H,11-12,15H2,1-2H3,(H,24,27);2*4-9,12H,10-11H2,1-3H3,(H,20,24)(H,21,22);3-9,12H,10-11,13H2,1-2H3,(H,20,23);1-10,24H,(H,22,23)(H2,19,20,21);3-9,12H,10-11H2,1-2H3,(H,19,23)(H,20,21);4-9H,10H2,1-3H3,(H,19,22)(H,20,21)
InChIKeyAYHFEEMMNGVAHQ-UHFFFAOYSA-N
MW2341.76 g/mol
LogP21.89
Rot. Bonds36

About 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide

3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide (PubChem CID 157268733) has the molecular formula C134H141N25O15 and a molecular weight of 2341.76 g/mol. Its IUPAC name is 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide.

Molecular Properties

Compound Name3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide
PubChem CID157268733
Molecular FormulaC134H141N25O15
Molecular Weight2341.76 g/mol
Exact Mass2340.10
IUPAC Name3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide
SMILESCNC(=O)c1cc(Cc2nc3ccccc3n2CCOC)cc2ccccc12.CNC(=O)c1cccc(N(CCOC)C2=Nc3ccccc3C2)c1.CNC(=O)c1cccc(NC2=Nc3cc(C)c(C)cc3C2)c1.CNC(=O)c1cccc(Nc2nc3c(OC)cccc3n2CCOC)c1.CNC(=O)c1cccc(Nc2nc3cccc(OC)c3n2CCOC)c1.CNC(=O)c1cccc(Nc2nc3ccccc3n2CCOC)c1.O=C(NO)c1cc(Nc2nc3ccccc3[nH]2)cc2ccccc12
InChIInChI=1S/C23H23N3O2.2C19H22N4O3.C19H21N3O2.C18H14N4O2.C18H20N4O2.C18H19N3O/c1-24-23(27)19-14-16(13-17-7-3-4-8-18(17)19)15-22-25-20-9-5-6-10-21(20)26(22)11-12-28-2;1-20-18(24)13-6-4-7-14(12-13)21-19-22-17-15(23(19)10-11-25-2)8-5-9-16(17)26-3;1-20-18(24)13-6-4-7-14(12-13)21-19-22-15-8-5-9-16(26-3)17(15)23(19)10-11-25-2;1-20-19(23)15-7-5-8-16(12-15)22(10-11-24-2)18-13-14-6-3-4-9-17(14)21-18;23-17(22-24)14-10-12(9-11-5-1-2-6-13(11)14)19-18-20-15-7-3-4-8-16(15)21-18;1-19-17(23)13-6-5-7-14(12-13)20-18-21-15-8-3-4-9-16(15)22(18)10-11-24-2;1-11-7-14-10-17(21-16(14)8-12(11)2)20-15-6-4-5-13(9-15)18(22)19-3/h3-10,13-14H,11-12,15H2,1-2H3,(H,24,27);2*4-9,12H,10-11H2,1-3H3,(H,20,24)(H,21,22);3-9,12H,10-11,13H2,1-2H3,(H,20,23);1-10,24H,(H,22,23)(H2,19,20,21);3-9,12H,10-11H2,1-2H3,(H,19,23)(H,20,21);4-9H,10H2,1-3H3,(H,19,22)(H,20,21)
InChIKeyAYHFEEMMNGVAHQ-UHFFFAOYSA-N
XLogP21.89
TPSA476.61 Ų
H-Bond Donors14
H-Bond Acceptors32
Rotatable Bonds36
Heavy Atoms174
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002341.76
LogP ≤ 521.89
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide with MolForge

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Related Compounds

N-hydroxy-3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]benzamide
CID 134459830
2-bromo-1-(2-methoxyethyl)benzimidazole;N-hydroxy-3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]benzamide;methyl 3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]benzoate
CID 157127485
3-[[6-cyano-1-(2-methoxyethyl)-5-(trifluoromethyl)benzimidazol-2-yl]amino]-N-hydroxybenzamide
CID 134459646
N-[[1-[3-(2-methoxyphenoxy)propyl]benzimidazol-2-yl]methyl]-3-methylbenzamide
CID 17007329
methyl 3-[[6-isocyano-1-(2-methoxyethyl)-5-methylbenzimidazol-2-yl]amino]benzoate
CID 160774513
N-[5-[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]pentyl]-3-methylbenzamide
CID 16990299
N-[2-[1-[4-(2,3-dimethylphenoxy)butyl]benzimidazol-2-yl]ethyl]-3,4,5-trimethoxybenzamide
CID 16977075
3-[(6-chloro-3H-indol-2-yl)amino]-N-methylbenzamide
CID 157203662
3-bromo-N-[[1-(3-naphthalen-1-yloxypropyl)benzimidazol-2-yl]methyl]benzamide
CID 17008150
3,4-dimethoxy-N-[2-[1-(3-naphthalen-1-yloxypropyl)benzimidazol-2-yl]ethyl]benzamide
CID 16976917
3-[[1-(5-aminopentyl)-5-cyano-6-(trifluoromethyl)benzimidazol-2-yl]amino]-N-hydroxybenzamide;3-[(5-chloro-6-fluoro-1-hexylbenzimidazol-2-yl)amino]-N-hydroxybenzamide;3-[(5,6-dichloro-1-hexylbenzimidazol-2-yl)amino]-N-hydroxybenzamide;3-[[1-(2-methoxyethyl)-5-phenyl-6-(trifluoromethyl)benzimidazol-2-yl]amino]-N-methylbenzamide
CID 161466464
N-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 91820908

Frequently Asked Questions

What is the IUPAC name of 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide?
The IUPAC name of 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide (CID 157268733) is 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide.
What is the SMILES notation for 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide?
The canonical SMILES for 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide is CNC(=O)c1cc(Cc2nc3ccccc3n2CCOC)cc2ccccc12.CNC(=O)c1cccc(N(CCOC)C2=Nc3ccccc3C2)c1.CNC(=O)c1cccc(NC2=Nc3cc(C)c(C)cc3C2)c1.CNC(=O)c1cccc(Nc2nc3c(OC)cccc3n2CCOC)c1.CNC(=O)c1cccc(Nc2nc3cccc(OC)c3n2CCOC)c1.CNC(=O)c1cccc(Nc2nc3ccccc3n2CCOC)c1.O=C(NO)c1cc(Nc2nc3ccccc3[nH]2)cc2ccccc12.
What is the InChIKey of 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide?
The InChIKey is AYHFEEMMNGVAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2.2C19H22N4O3.C19H21N3O2.C18H14N4O2.C18H20N4O2.C18H19N3O/c1-24-23(27)19-14-16(13-17-7-3-4-8-18(17)19)15-22-25-20-9-5-6-10-21(20)26(22)11-12-28-2;1-20-18(24)13-6-4-7-14(12-13)21-19-22-17-15(23(19)10-11-25-2)8-5-9-16(17)26-3;1-20-18(24)13-6-4-7-14(12-13)21-19-22-15-8-5-9-16(26-3)17(15)23(19)10-11-25-2;1-20-19(23)15-7-5-8-16(12-15)22(10-11-24-2)18-13-14-6-3-4-9-17(14)21-18;23-17(22-24)14-10-12(9-11-5-1-2-6-13(11)14)19-18-20-15-7-3-4-8-16(15)21-18;1-19-17(23)13-6-5-7-14(12-13)20-18-21-15-8-3-4-9-16(15)22(18)10-11-24-2;1-11-7-14-10-17(21-16(14)8-12(11)2)20-15-6-4-5-13(9-15)18(22)19-3/h3-10,13-14H,11-12,15H2,1-2H3,(H,24,27);2*4-9,12H,10-11H2,1-3H3,(H,20,24)(H,21,22);3-9,12H,10-11,13H2,1-2H3,(H,20,23);1-10,24H,(H,22,23)(H2,19,20,21);3-9,12H,10-11H2,1-2H3,(H,19,23)(H,20,21);4-9H,10H2,1-3H3,(H,19,22)(H,20,21).
What are the key properties of 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide?
3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide has a molecular weight of 2341.76 g/mol, XLogP of 21.89, 36 rotatable bonds, 14 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-benzimidazol-2-ylamino)-N-hydroxynaphthalene-1-carboxamide;3-[(5,6-dimethyl-3H-indol-2-yl)amino]-N-methylbenzamide;3-[3H-indol-2-yl(2-methoxyethyl)amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[1-(2-methoxyethyl)benzimidazol-2-yl]methyl]-N-methylnaphthalene-1-carboxamide;3-[[4-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide;3-[[7-methoxy-1-(2-methoxyethyl)benzimidazol-2-yl]amino]-N-methylbenzamide is sourced from PubChem (CID 157268733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).