3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine

C15H14ClN3 — CID 20777187

IUPAC3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine
SMILESCCc1nc2cccnc2n1Cc1ccccc1Cl
InChIInChI=1S/C15H14ClN3/c1-2-14-18-13-8-5-9-17-15(13)19(14)10-11-6-3-4-7-12(11)16/h3-9H,2,10H2,1H3
InChIKeyVUKAAGJIVPZCAS-UHFFFAOYSA-N
MW271.75 g/mol
LogP3.70
Rot. Bonds3

About 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine

3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine (PubChem CID 20777187) has the molecular formula C15H14ClN3 and a molecular weight of 271.75 g/mol. Its IUPAC name is 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine
PubChem CID20777187
Molecular FormulaC15H14ClN3
Molecular Weight271.75 g/mol
Exact Mass271.09
IUPAC Name3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine
SMILESCCc1nc2cccnc2n1Cc1ccccc1Cl
InChIInChI=1S/C15H14ClN3/c1-2-14-18-13-8-5-9-17-15(13)19(14)10-11-6-3-4-7-12(11)16/h3-9H,2,10H2,1H3
InChIKeyVUKAAGJIVPZCAS-UHFFFAOYSA-N
XLogP3.70
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.75
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-chlorophenyl)methyl]-2-(2-methoxyethyl)imidazo[4,5-b]pyridine
CID 117159959
3-[(2-chlorophenyl)methyl]-2-(3-methoxypropyl)imidazo[4,5-b]pyridine
CID 117159702
2-[(2-chlorophenyl)methyl]-3-propylimidazo[4,5-b]pyridine
CID 117165274
2-ethyl-3-propylimidazo[4,5-b]pyridine
CID 20777190
2-(chloromethyl)-3-[(3-ethyl-2-pyridinyl)methyl]imidazo[4,5-b]pyridine
CID 82741938
2-[(2-chlorophenyl)methyl]-3-(3-methoxypropyl)imidazo[4,5-b]pyridine
CID 117165163
2-(chloromethyl)-3-[(2,6-dichlorophenyl)methyl]imidazo[4,5-b]pyridine
CID 71646538
3-[(2-chlorophenyl)methyl]-2-ethyl-7-piperazin-1-ylimidazo[4,5-b]pyridine
CID 126720448
2-benzyl-3-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridine
CID 117165030
2-ethyl-3-(2-methoxyethyl)imidazo[4,5-b]pyridine
CID 117165576
2-(2,2-dimethylpropyl)-3-[(2-fluorophenyl)methyl]imidazo[4,5-b]pyridine
CID 117165916
N-[[3-[(2-chlorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-N-(2-methylpropyl)-2-pyrrol-1-ylbenzamide
CID 69301713

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine?
The IUPAC name of 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine (CID 20777187) is 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine.
What is the SMILES notation for 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine?
The canonical SMILES for 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine is CCc1nc2cccnc2n1Cc1ccccc1Cl.
What is the InChIKey of 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine?
The InChIKey is VUKAAGJIVPZCAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3/c1-2-14-18-13-8-5-9-17-15(13)19(14)10-11-6-3-4-7-12(11)16/h3-9H,2,10H2,1H3.
What are the key properties of 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine?
3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine has a molecular weight of 271.75 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chlorophenyl)methyl]-2-ethylimidazo[4,5-b]pyridine is sourced from PubChem (CID 20777187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).