2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile

C12H10ClN3 — CID 139487891

IUPAC2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(C2CC2)cn2cc(CCl)nc12
InChIInChI=1S/C12H10ClN3/c13-4-11-7-16-6-10(8-1-2-8)3-9(5-14)12(16)15-11/h3,6-8H,1-2,4H2
InChIKeyGRQVCUCESKLKLO-UHFFFAOYSA-N
MW231.69 g/mol
LogP2.82
Rot. Bonds2

About 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile

2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile (PubChem CID 139487891) has the molecular formula C12H10ClN3 and a molecular weight of 231.69 g/mol. Its IUPAC name is 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile.

Molecular Properties

Compound Name2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile
PubChem CID139487891
Molecular FormulaC12H10ClN3
Molecular Weight231.69 g/mol
Exact Mass231.06
IUPAC Name2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(C2CC2)cn2cc(CCl)nc12
InChIInChI=1S/C12H10ClN3/c13-4-11-7-16-6-10(8-1-2-8)3-9(5-14)12(16)15-11/h3,6-8H,1-2,4H2
InChIKeyGRQVCUCESKLKLO-UHFFFAOYSA-N
XLogP2.82
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.69
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile;hydrochloride
CID 165130814
2-(chloromethyl)-6-cyclopropyl-8-fluoroimidazo[1,2-a]pyridine
CID 139487322
1-(6-cyclopropyl-8-methylimidazo[1,2-a]pyridin-2-yl)-N-methylmethanamine
CID 175623441
[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl carbamate
CID 175507912
8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile
CID 165132689
N-[(7-chloroimidazo[1,5-a]pyridin-1-yl)methyl]-5-[(8-cyano-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide
CID 139487371
(Z)-2-amino-3-[amino-[(8-cyano-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]amino]-N-(1-amino-6,7-dihydro-5H-cyclopenta[c]pyridin-5-yl)prop-2-enamide
CID 175623437
2-[[5-[3-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)propanoyl]-1,3,4-oxadiazol-2-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile
CID 160672678
2-(azidomethyl)-6-cyclopropyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 139487753
8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine
CID 170693422
8-bromo-2-[(2-chloro-6-methyl-4-pyridinyl)oxymethyl]-6-cyclopropylimidazo[1,2-a]pyridine
CID 165132150
1-[2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]ethanone
CID 165131814

Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile?
The IUPAC name of 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile (CID 139487891) is 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile.
What is the SMILES notation for 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile?
The canonical SMILES for 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile is N#Cc1cc(C2CC2)cn2cc(CCl)nc12.
What is the InChIKey of 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile?
The InChIKey is GRQVCUCESKLKLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3/c13-4-11-7-16-6-10(8-1-2-8)3-9(5-14)12(16)15-11/h3,6-8H,1-2,4H2.
What are the key properties of 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile?
2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile has a molecular weight of 231.69 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridine-8-carbonitrile is sourced from PubChem (CID 139487891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).