1-pentylimidazo[4,5-c]pyridine

C11H15N3 — CID 142023174

IUPAC1-pentylimidazo[4,5-c]pyridine
SMILESCCCCCn1cnc2cnccc21
InChIInChI=1S/C11H15N3/c1-2-3-4-7-14-9-13-10-8-12-6-5-11(10)14/h5-6,8-9H,2-4,7H2,1H3
InChIKeyZPHKOUVIJLFGMI-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.62
Rot. Bonds4

About 1-pentylimidazo[4,5-c]pyridine

1-pentylimidazo[4,5-c]pyridine (PubChem CID 142023174) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-pentylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-pentylimidazo[4,5-c]pyridine
PubChem CID142023174
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1-pentylimidazo[4,5-c]pyridine
SMILESCCCCCn1cnc2cnccc21
InChIInChI=1S/C11H15N3/c1-2-3-4-7-14-9-13-10-8-12-6-5-11(10)14/h5-6,8-9H,2-4,7H2,1H3
InChIKeyZPHKOUVIJLFGMI-UHFFFAOYSA-N
XLogP2.62
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

bis(1-butylbenzimidazole);ethane
CID 142164287
1-ethylimidazo[4,5-b]pyridine;1-ethylimidazo[4,5-c]pyridine
CID 145213669
5,6-dimethyl-1-nonylbenzimidazole
CID 16994999
1-butyl-5-fluorobenzimidazole
CID 134239298
1-butyl-6-pyridin-4-ylimidazo[4,5-b]pyridine
CID 23454714
1-pentylpyrrolo[3,2-c]pyridine-3-carboxamide
CID 159841368
2-butyl-1-methylimidazo[4,5-c]pyridine
CID 150484060
N-[2-(benzimidazol-1-yl)ethyl]hexan-1-amine
CID 62563672
7-butylpurine
CID 54540846
1-butylpyrrolo[3,2-c]pyridine-3-carboxylic acid
CID 90178300
4-(3-pentylimidazol-4-yl)pyridin-2-amine
CID 114716246
3,7-dipropylimidazo[4,5-f]benzimidazole
CID 46862422

Frequently Asked Questions

What is the IUPAC name of 1-pentylimidazo[4,5-c]pyridine?
The IUPAC name of 1-pentylimidazo[4,5-c]pyridine (CID 142023174) is 1-pentylimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-pentylimidazo[4,5-c]pyridine?
The canonical SMILES for 1-pentylimidazo[4,5-c]pyridine is CCCCCn1cnc2cnccc21.
What is the InChIKey of 1-pentylimidazo[4,5-c]pyridine?
The InChIKey is ZPHKOUVIJLFGMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-2-3-4-7-14-9-13-10-8-12-6-5-11(10)14/h5-6,8-9H,2-4,7H2,1H3.
What are the key properties of 1-pentylimidazo[4,5-c]pyridine?
1-pentylimidazo[4,5-c]pyridine has a molecular weight of 189.26 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pentylimidazo[4,5-c]pyridine is sourced from PubChem (CID 142023174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).