N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide

C19H15N3O2S — CID 52667720

IUPACN-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide
SMILESCOc1cc(-c2ccccc2)sc1C(=O)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C19H15N3O2S/c1-24-15-11-16(12-7-3-2-4-8-12)25-17(15)18(23)22-19-20-13-9-5-6-10-14(13)21-19/h2-11H,1H3,(H2,20,21,22,23)
InChIKeyYXFDPFQLJWAGFC-UHFFFAOYSA-N
MW349.42 g/mol
LogP4.55
Rot. Bonds4

About N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide

N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide (PubChem CID 52667720) has the molecular formula C19H15N3O2S and a molecular weight of 349.42 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide
PubChem CID52667720
Molecular FormulaC19H15N3O2S
Molecular Weight349.42 g/mol
Exact Mass349.09
IUPAC NameN-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide
SMILESCOc1cc(-c2ccccc2)sc1C(=O)Nc1nc2ccccc2[nH]1
InChIInChI=1S/C19H15N3O2S/c1-24-15-11-16(12-7-3-2-4-8-12)25-17(15)18(23)22-19-20-13-9-5-6-10-14(13)21-19/h2-11H,1H3,(H2,20,21,22,23)
InChIKeyYXFDPFQLJWAGFC-UHFFFAOYSA-N
XLogP4.55
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.42
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-benzimidazol-2-yl)-2,4-dimethoxybenzamide
CID 4695097
N-(3-acetamidophenyl)-3-methoxy-5-phenylthiophene-2-carboxamide
CID 55834572
N-(1H-benzimidazol-2-yl)-4-(4-methoxyphenyl)-5-methylthiophene-2-carboxamide
CID 35808128
N-(1H-benzimidazol-2-yl)-4-bromo-2-methoxybenzamide
CID 78987804
N-(1H-benzimidazol-2-yl)-4,6,7-trimethoxy-1H-indole-2-carboxamide
CID 46445811
2-amino-N-(1H-benzimidazol-2-yl)-4-methoxybenzamide
CID 115413254
N-(1H-benzimidazol-2-yl)-4-(difluoromethoxy)-3,5-dimethoxybenzamide
CID 167880656
N-(1H-benzimidazol-2-yl)-3-phenyl-1H-pyrazole-5-carboxamide
CID 27649691
N-(1H-benzimidazol-2-yl)-1H-benzimidazole-2-carboxamide
CID 12620222
methyl N-(1H-benzimidazol-2-yl)carbamoperoxoate
CID 13411944
N-(1H-benzimidazol-2-yl)-5-bromo-4-methylthiophene-2-carboxamide
CID 79934420
N-(1H-benzimidazol-2-yl)-6-methoxypyridine-3-carboxamide
CID 27649712

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide (CID 52667720) is N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide is COc1cc(-c2ccccc2)sc1C(=O)Nc1nc2ccccc2[nH]1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide?
The InChIKey is YXFDPFQLJWAGFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2S/c1-24-15-11-16(12-7-3-2-4-8-12)25-17(15)18(23)22-19-20-13-9-5-6-10-14(13)21-19/h2-11H,1H3,(H2,20,21,22,23).
What are the key properties of N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide?
N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide has a molecular weight of 349.42 g/mol, XLogP of 4.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-3-methoxy-5-phenylthiophene-2-carboxamide is sourced from PubChem (CID 52667720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).