N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide

C14H19N3O — CID 4652021

IUPACN-[1-(1H-benzimidazol-2-yl)pentyl]acetamide
SMILESCCCCC(NC(C)=O)c1nc2ccccc2[nH]1
InChIInChI=1S/C14H19N3O/c1-3-4-7-13(15-10(2)18)14-16-11-8-5-6-9-12(11)17-14/h5-6,8-9,13H,3-4,7H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyVLULDFKKUDHYHH-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.93
Rot. Bonds5

About N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide

N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide (PubChem CID 4652021) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide.

Molecular Properties

Compound NameN-[1-(1H-benzimidazol-2-yl)pentyl]acetamide
PubChem CID4652021
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN-[1-(1H-benzimidazol-2-yl)pentyl]acetamide
SMILESCCCCC(NC(C)=O)c1nc2ccccc2[nH]1
InChIInChI=1S/C14H19N3O/c1-3-4-7-13(15-10(2)18)14-16-11-8-5-6-9-12(11)17-14/h5-6,8-9,13H,3-4,7H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyVLULDFKKUDHYHH-UHFFFAOYSA-N
XLogP2.93
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-acetamido-3-(1H-benzimidazol-2-yl)propanoic acid
CID 142267067
N-[1-(1H-benzimidazol-2-yl)pentyl]-2,6-dimethoxybenzamide
CID 4963983
N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]hexanamide
CID 46603847
N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide
CID 3149717
2-hexadecan-7-yl-1H-benzimidazole
CID 54269360
N-[1-(1H-benzimidazol-2-yl)butyl]-4-tert-butylbenzamide
CID 3484106
N-[(1S)-1-(1H-benzimidazol-2-yl)butyl]-2-fluorobenzamide
CID 948873
N-[(1S)-1-(1H-benzimidazol-2-yl)propyl]-4-oxo-4-phenylbutanamide
CID 95175043
N-[(1S)-4-amino-1-(1H-benzimidazol-2-yl)butyl]benzamide
CID 166563053
(1R)-1-(1H-benzimidazol-2-yl)pentan-1-amine
CID 27506225
2-amino-N-[1-(1H-benzimidazol-2-yl)-3-methylbutyl]pentanamide
CID 119836762
3-acetamido-N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]propanamide
CID 4878970

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide?
The IUPAC name of N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide (CID 4652021) is N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide.
What is the SMILES notation for N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide?
The canonical SMILES for N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide is CCCCC(NC(C)=O)c1nc2ccccc2[nH]1.
What is the InChIKey of N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide?
The InChIKey is VLULDFKKUDHYHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-3-4-7-13(15-10(2)18)14-16-11-8-5-6-9-12(11)17-14/h5-6,8-9,13H,3-4,7H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide?
N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide has a molecular weight of 245.33 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-benzimidazol-2-yl)pentyl]acetamide is sourced from PubChem (CID 4652021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).