2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide

C16H15N3O2 — CID 110772471

IUPAC2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)Cc1ccc2nc[nH]c2c1
InChIInChI=1S/C16H15N3O2/c1-21-15-5-3-2-4-13(15)19-16(20)9-11-6-7-12-14(8-11)18-10-17-12/h2-8,10H,9H2,1H3,(H,17,18)(H,19,20)
InChIKeyRAEQZTJKTRXDFO-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.75
Rot. Bonds4

About 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide

2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide (PubChem CID 110772471) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide
PubChem CID110772471
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)Cc1ccc2nc[nH]c2c1
InChIInChI=1S/C16H15N3O2/c1-21-15-5-3-2-4-13(15)19-16(20)9-11-6-7-12-14(8-11)18-10-17-12/h2-8,10H,9H2,1H3,(H,17,18)(H,19,20)
InChIKeyRAEQZTJKTRXDFO-UHFFFAOYSA-N
XLogP2.75
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3H-benzimidazol-5-yl)-N-[2-(2-ethoxyphenyl)phenyl]acetamide
CID 175661419
methyl 2-[3-[[2-(3H-benzimidazol-5-yl)acetyl]amino]phenoxy]acetate
CID 166393940
methyl 4-[2-(3H-benzimidazol-5-yl)acetyl]piperazine-1-carboxylate
CID 110803448
N-(2-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2599423
2-(3H-benzimidazol-5-yl)-N-[4-(dimethylamino)phenyl]acetamide
CID 110772495
2-(2-hydroxyphenyl)-N-(2-methoxyphenyl)acetamide
CID 60615730
2-(4-acetamidophenyl)-N-(2-methoxyphenyl)acetamide
CID 17410326
2-(3H-benzimidazol-5-yl)-N-[4-(diethylamino)phenyl]acetamide
CID 110772496
2-(3,4-dimethoxyphenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]acetamide
CID 112998555
2-(3H-benzimidazol-5-yl)-N-(3-phenylpropyl)acetamide
CID 110772427
N-(2-methoxyphenyl)-3-(2-oxo-3H-1,3-benzoxazol-5-yl)propanamide
CID 110390488
N-(2-methoxy-5-methylphenyl)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide
CID 110772643

Frequently Asked Questions

What is the IUPAC name of 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide (CID 110772471) is 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)Cc1ccc2nc[nH]c2c1.
What is the InChIKey of 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide?
The InChIKey is RAEQZTJKTRXDFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-21-15-5-3-2-4-13(15)19-16(20)9-11-6-7-12-14(8-11)18-10-17-12/h2-8,10H,9H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide?
2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide has a molecular weight of 281.32 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3H-benzimidazol-5-yl)-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 110772471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).