N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide

C15H12Cl2N4O2 — CID 22663370

IUPACN-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide
SMILESCOc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2nc(C)[nH]c12
InChIInChI=1S/C15H12Cl2N4O2/c1-7-19-12-8(3-4-11(23-2)14(12)20-7)15(22)21-13-9(16)5-18-6-10(13)17/h3-6H,1-2H3,(H,19,20)(H,18,21,22)
InChIKeyUGLXTJFJHNLMTN-UHFFFAOYSA-N
MW351.19 g/mol
LogP3.83
Rot. Bonds3

About N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide

N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide (PubChem CID 22663370) has the molecular formula C15H12Cl2N4O2 and a molecular weight of 351.19 g/mol. Its IUPAC name is N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide
PubChem CID22663370
Molecular FormulaC15H12Cl2N4O2
Molecular Weight351.19 g/mol
Exact Mass350.03
IUPAC NameN-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide
SMILESCOc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2nc(C)[nH]c12
InChIInChI=1S/C15H12Cl2N4O2/c1-7-19-12-8(3-4-11(23-2)14(12)20-7)15(22)21-13-9(16)5-18-6-10(13)17/h3-6H,1-2H3,(H,19,20)(H,18,21,22)
InChIKeyUGLXTJFJHNLMTN-UHFFFAOYSA-N
XLogP3.83
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.19
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide with MolForge

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Related Compounds

Indole chloropyridinyl-ester derived, 7j
CID 156907347
Indole chloropyridinyl-ester derived, 7k
CID 156907348
2-cyclopropyl-N-(3,5-dichloro-4-pyridinyl)-7-methoxy-1H-benzimidazole-4-carboxamide
CID 22663188
Indole chloropyridinyl-ester derived, 9f
CID 156907355
N-(3,5-Dichloro-4-pyridinyl)-2-(trifluoromethyl)-4-methoxy-1H-benzimidazole-7-carboxamide
CID 18316653
N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-propan-2-yl-1H-benzimidazole-4-carboxamide
CID 22663199
2-cyclopentyl-N-(3,5-dichloro-4-pyridinyl)-7-methoxy-1H-benzimidazole-4-carboxamide
CID 22663201
2-benzyl-N-(3,5-dichloro-4-pyridinyl)-7-methoxy-1H-benzimidazole-4-carboxamide
CID 22663228
N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-(methoxymethyl)-1H-benzimidazole-4-carboxamide
CID 22663297
N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-(2-phenylethyl)-1H-benzimidazole-4-carboxamide
CID 22663307
2-cyclopentyl-N-(3,5-dichloro-4-pyridinyl)-7-methoxy-3-methylbenzimidazole-4-carboxamide
CID 22663362
N-(3,5-Dichloro-4-pyridinyl)-1-methyl-2-(trifluoromethyl)-4-methoxy-1H-benzimidazole-7-carboxamide
CID 44288639

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide?
The IUPAC name of N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide (CID 22663370) is N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide.
What is the SMILES notation for N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide?
The canonical SMILES for N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide is COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2nc(C)[nH]c12.
What is the InChIKey of N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide?
The InChIKey is UGLXTJFJHNLMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N4O2/c1-7-19-12-8(3-4-11(23-2)14(12)20-7)15(22)21-13-9(16)5-18-6-10(13)17/h3-6H,1-2H3,(H,19,20)(H,18,21,22).
What are the key properties of N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide?
N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide has a molecular weight of 351.19 g/mol, XLogP of 3.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-methyl-1H-benzimidazole-4-carboxamide is sourced from PubChem (CID 22663370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).