2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride

C12H13Cl2N3 — CID 156786860

IUPAC2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride
SMILESCl.Clc1ccccc1-c1nc2c([nH]1)CNCC2
InChIInChI=1S/C12H12ClN3.ClH/c13-9-4-2-1-3-8(9)12-15-10-5-6-14-7-11(10)16-12;/h1-4,14H,5-7H2,(H,15,16);1H
InChIKeyCNDFWTDAACUHGG-UHFFFAOYSA-N
MW270.16 g/mol
LogP2.80
Rot. Bonds1

About 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride

2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride (PubChem CID 156786860) has the molecular formula C12H13Cl2N3 and a molecular weight of 270.16 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride.

Molecular Properties

Compound Name2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride
PubChem CID156786860
Molecular FormulaC12H13Cl2N3
Molecular Weight270.16 g/mol
Exact Mass269.05
IUPAC Name2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride
SMILESCl.Clc1ccccc1-c1nc2c([nH]1)CNCC2
InChIInChI=1S/C12H12ClN3.ClH/c13-9-4-2-1-3-8(9)12-15-10-5-6-14-7-11(10)16-12;/h1-4,14H,5-7H2,(H,15,16);1H
InChIKeyCNDFWTDAACUHGG-UHFFFAOYSA-N
XLogP2.80
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.16
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CID 156786901
3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-quinolin-2-one
CID 137184532
5-chloro-1,3-dihydroinden-2-one;5-(5-chloro-2,3-dihydro-1H-inden-2-yl)-2-(2-chlorophenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CID 163810638
2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
CID 154901265
2-(2-chlorophenyl)-5,6,7,8-tetrahydro-1H-quinazoline-4-thione
CID 106477299
2-(2-chlorophenyl)-5-(11-tricyclo[6.2.1.02,7]undeca-2,4,6-trienyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 156786739
2-(4-piperidin-1-ylsulfonylphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
CID 154900025
2-(5-bromothiophen-2-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CID 117166985
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CID 72917543
2-(2,3-dimethoxy-5-methylphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
CID 154899672
2-(2-butoxy-5-methylphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
CID 154898940
3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)pyrazole-1-carboxamide
CID 173158895

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride?
The IUPAC name of 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride (CID 156786860) is 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride.
What is the SMILES notation for 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride?
The canonical SMILES for 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride is Cl.Clc1ccccc1-c1nc2c([nH]1)CNCC2.
What is the InChIKey of 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride?
The InChIKey is CNDFWTDAACUHGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3.ClH/c13-9-4-2-1-3-8(9)12-15-10-5-6-14-7-11(10)16-12;/h1-4,14H,5-7H2,(H,15,16);1H.
What are the key properties of 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride?
2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride has a molecular weight of 270.16 g/mol, XLogP of 2.80, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;hydrochloride is sourced from PubChem (CID 156786860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).