N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide

C18H19N3O2 — CID 2974525

IUPACN-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide
SMILESCCCC(=O)Nc1ccc2c(c1)ncn2-c1ccccc1OC
InChIInChI=1S/C18H19N3O2/c1-3-6-18(22)20-13-9-10-15-14(11-13)19-12-21(15)16-7-4-5-8-17(16)23-2/h4-5,7-12H,3,6H2,1-2H3,(H,20,22)
InChIKeyRJICUGHFMBZLQD-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.77
Rot. Bonds5

About N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide

N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide (PubChem CID 2974525) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide
PubChem CID2974525
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide
SMILESCCCC(=O)Nc1ccc2c(c1)ncn2-c1ccccc1OC
InChIInChI=1S/C18H19N3O2/c1-3-6-18(22)20-13-9-10-15-14(11-13)19-12-21(15)16-7-4-5-8-17(16)23-2/h4-5,7-12H,3,6H2,1-2H3,(H,20,22)
InChIKeyRJICUGHFMBZLQD-UHFFFAOYSA-N
XLogP3.77
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-ethylbenzimidazol-5-yl)butanamide
CID 2973046
N-ethyl-1-(2-methoxyphenyl)-N-propylbenzimidazole-5-carboxamide
CID 156811262
1-(2-methoxyphenyl)-N-pyridin-2-ylbenzimidazol-5-amine
CID 59373052
N-[4-(benzimidazol-1-yl)phenyl]butanamide
CID 17479709
N-(1,2-dimethylbenzimidazol-5-yl)butanamide
CID 965373
3-(benzimidazol-1-yl)-N-(3,4-dimethoxyphenyl)propanamide
CID 36842808
N-[4-(butanoylamino)phenyl]-2,6-dimethoxybenzamide
CID 954631
3-(3,4-dimethoxyphenyl)-N-(1-methylbenzimidazol-5-yl)propanamide
CID 110744582
N-[4-(1,3-dioxoisoindol-2-yl)-3-methoxyphenyl]butanamide
CID 918540
N-phenazin-2-ylbutanamide
CID 73349412
3,4,5-trimethoxy-N-[1-(4-methylphenyl)benzimidazol-5-yl]benzamide
CID 1077763
N-(3-chloro-4-methoxyphenyl)butanamide
CID 875969

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide?
The IUPAC name of N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide (CID 2974525) is N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide.
What is the SMILES notation for N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide?
The canonical SMILES for N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide is CCCC(=O)Nc1ccc2c(c1)ncn2-c1ccccc1OC.
What is the InChIKey of N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide?
The InChIKey is RJICUGHFMBZLQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-3-6-18(22)20-13-9-10-15-14(11-13)19-12-21(15)16-7-4-5-8-17(16)23-2/h4-5,7-12H,3,6H2,1-2H3,(H,20,22).
What are the key properties of N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide?
N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide has a molecular weight of 309.37 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)benzimidazol-5-yl]butanamide is sourced from PubChem (CID 2974525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).