1-(3-ethyl-2-pyridinyl)benzimidazole

C14H13N3 — CID 148503736

IUPAC1-(3-ethyl-2-pyridinyl)benzimidazole
SMILESCCc1cccnc1-n1cnc2ccccc21
InChIInChI=1S/C14H13N3/c1-2-11-6-5-9-15-14(11)17-10-16-12-7-3-4-8-13(12)17/h3-10H,2H2,1H3
InChIKeyMLDUHAAKNPPIJU-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.98
Rot. Bonds2

About 1-(3-ethyl-2-pyridinyl)benzimidazole

1-(3-ethyl-2-pyridinyl)benzimidazole (PubChem CID 148503736) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-(3-ethyl-2-pyridinyl)benzimidazole.

Molecular Properties

Compound Name1-(3-ethyl-2-pyridinyl)benzimidazole
PubChem CID148503736
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Name1-(3-ethyl-2-pyridinyl)benzimidazole
SMILESCCc1cccnc1-n1cnc2ccccc21
InChIInChI=1S/C14H13N3/c1-2-11-6-5-9-15-14(11)17-10-16-12-7-3-4-8-13(12)17/h3-10H,2H2,1H3
InChIKeyMLDUHAAKNPPIJU-UHFFFAOYSA-N
XLogP2.98
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(benzimidazol-1-yl)-3-pyridinyl]methanamine;dihydrochloride
CID 50988410
1-(2-ethylphenyl)benzimidazole
CID 22078308
(2S)-N-[[2-(benzimidazol-1-yl)-3-pyridinyl]methyl]-2-hydroxy-2-phenylpropanamide
CID 95191566
N-[[2-(benzimidazol-1-yl)-3-pyridinyl]methyl]-1-methylpiperidine-2-carboxamide
CID 45182568
(2S)-N-[[2-(benzimidazol-1-yl)-3-pyridinyl]methyl]-2-methyl-3-(1,2,4-triazol-1-yl)propanamide
CID 95223644
1-[3-[2-(3-methylsulfonylphenyl)-2-pyridin-3-ylethyl]-2-pyridinyl]benzimidazole
CID 66829901
3-(benzimidazol-1-yl)-1-ethylquinoxalin-2-one
CID 162419791
2-(benzimidazol-1-yl)-3-methylquinoxaline
CID 115579889
4-(benzimidazol-1-yl)pyrazolo[1,5-a]pyrazine
CID 104734400
1-methylbenzimidazole;propane
CID 91130597
N-[[2-(benzimidazol-1-yl)-3-pyridinyl]methyl]-3-[(4S)-2,5-dioxoimidazolidin-4-yl]propanamide
CID 95200164
4-(benzimidazol-1-yl)-6-(4-ethylpiperazin-1-yl)pyrimidin-5-amine
CID 19138513

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-2-pyridinyl)benzimidazole?
The IUPAC name of 1-(3-ethyl-2-pyridinyl)benzimidazole (CID 148503736) is 1-(3-ethyl-2-pyridinyl)benzimidazole.
What is the SMILES notation for 1-(3-ethyl-2-pyridinyl)benzimidazole?
The canonical SMILES for 1-(3-ethyl-2-pyridinyl)benzimidazole is CCc1cccnc1-n1cnc2ccccc21.
What is the InChIKey of 1-(3-ethyl-2-pyridinyl)benzimidazole?
The InChIKey is MLDUHAAKNPPIJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3/c1-2-11-6-5-9-15-14(11)17-10-16-12-7-3-4-8-13(12)17/h3-10H,2H2,1H3.
What are the key properties of 1-(3-ethyl-2-pyridinyl)benzimidazole?
1-(3-ethyl-2-pyridinyl)benzimidazole has a molecular weight of 223.28 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-2-pyridinyl)benzimidazole is sourced from PubChem (CID 148503736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).