4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole

C11H9ClN2 — CID 139495389

IUPAC4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole
SMILESClc1cccn2c3c(nc12)=CCCC=3
InChIInChI=1S/C11H9ClN2/c12-8-4-3-7-14-10-6-2-1-5-9(10)13-11(8)14/h3-7H,1-2H2
InChIKeyGVSHSGCVTNHOAI-UHFFFAOYSA-N
MW204.66 g/mol
LogP1.34
Rot. Bonds

About 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole

4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole (PubChem CID 139495389) has the molecular formula C11H9ClN2 and a molecular weight of 204.66 g/mol. Its IUPAC name is 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole.

Molecular Properties

Compound Name4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole
PubChem CID139495389
Molecular FormulaC11H9ClN2
Molecular Weight204.66 g/mol
Exact Mass204.05
IUPAC Name4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole
SMILESClc1cccn2c3c(nc12)=CCCC=3
InChIInChI=1S/C11H9ClN2/c12-8-4-3-7-14-10-6-2-1-5-9(10)13-11(8)14/h3-7H,1-2H2
InChIKeyGVSHSGCVTNHOAI-UHFFFAOYSA-N
XLogP1.34
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.66
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-chloro-2-methyl-3-phenylimidazo[1,2-a]pyridine
CID 103095206
8-chloro-2-cyclobutylimidazo[1,2-a]pyridin-3-amine
CID 103094983
(8-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methanol
CID 82529517
8-chloro-3-(4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridine
CID 103095082
2-(3-bromophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine
CID 103095006
(2-tert-butyl-8-chloroimidazo[1,2-a]pyridin-3-yl)methanol
CID 82529526
8-chloro-2-(2-methylpropyl)imidazo[1,2-a]pyridin-3-amine
CID 103095037
8-chloro-2-(2-fluorophenyl)-3-methylimidazo[1,2-a]pyridine
CID 103095201
8-chloro-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
CID 82529168
2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529103
8-chloro-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide
CID 82529717
8-chloro-3-propan-2-ylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 82529112

Frequently Asked Questions

What is the IUPAC name of 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole?
The IUPAC name of 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole (CID 139495389) is 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole.
What is the SMILES notation for 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole?
The canonical SMILES for 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole is Clc1cccn2c3c(nc12)=CCCC=3.
What is the InChIKey of 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole?
The InChIKey is GVSHSGCVTNHOAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2/c12-8-4-3-7-14-10-6-2-1-5-9(10)13-11(8)14/h3-7H,1-2H2.
What are the key properties of 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole?
4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole has a molecular weight of 204.66 g/mol, XLogP of 1.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7,8-dihydropyrido[1,2-a]benzimidazole is sourced from PubChem (CID 139495389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).