2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide

C17H17N3O3 — CID 110785285

IUPAC2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide
SMILESCOc1cccc(CC(=O)NCc2ccc3[nH]c(=O)[nH]c3c2)c1
InChIInChI=1S/C17H17N3O3/c1-23-13-4-2-3-11(7-13)9-16(21)18-10-12-5-6-14-15(8-12)20-17(22)19-14/h2-8H,9-10H2,1H3,(H,18,21)(H2,19,20,22)
InChIKeyFEYFUWFCDOXICL-UHFFFAOYSA-N
MW311.34 g/mol
LogP1.72
Rot. Bonds5

About 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide

2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide (PubChem CID 110785285) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide
PubChem CID110785285
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC Name2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide
SMILESCOc1cccc(CC(=O)NCc2ccc3[nH]c(=O)[nH]c3c2)c1
InChIInChI=1S/C17H17N3O3/c1-23-13-4-2-3-11(7-13)9-16(21)18-10-12-5-6-14-15(8-12)20-17(22)19-14/h2-8H,9-10H2,1H3,(H,18,21)(H2,19,20,22)
InChIKeyFEYFUWFCDOXICL-UHFFFAOYSA-N
XLogP1.72
TPSA86.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]-2-phenylacetamide
CID 110785246
N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 47292082
N-[(3-methoxyphenyl)methyl]-2-naphthalen-1-ylacetamide
CID 2086540
N-hydroxy-4-[[[2-(3-methoxyphenyl)acetyl]amino]methyl]benzamide
CID 90480233
N-[(3-methoxyphenyl)methyl]-2-(5-methyl-1H-pyrrol-3-yl)acetamide
CID 112522336
N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 115598846
2-(3-methoxyphenyl)-N-[(5-oxo-1,2-dihydropyrazol-3-yl)methyl]acetamide
CID 112536479
3-(3-methylphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]propanamide
CID 110785273
2-chloro-N-[(3-methoxyphenyl)methyl]acetamide
CID 4839545
2-[4-(difluoromethoxy)phenyl]-N-[(3-methoxyphenyl)methyl]acetamide
CID 32734290
1-benzyl-3-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]urea
CID 110775421
2-(3-methoxyphenyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]acetamide
CID 33117583

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide?
The IUPAC name of 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide (CID 110785285) is 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide?
The canonical SMILES for 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide is COc1cccc(CC(=O)NCc2ccc3[nH]c(=O)[nH]c3c2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide?
The InChIKey is FEYFUWFCDOXICL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c1-23-13-4-2-3-11(7-13)9-16(21)18-10-12-5-6-14-15(8-12)20-17(22)19-14/h2-8H,9-10H2,1H3,(H,18,21)(H2,19,20,22).
What are the key properties of 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide?
2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide has a molecular weight of 311.34 g/mol, XLogP of 1.72, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]acetamide is sourced from PubChem (CID 110785285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).