8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline

C14H12ClN3 — CID 150449079

IUPAC8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline
SMILESClc1ccc2ncc3[nH]c(C4CCC4)nc3c2c1
InChIInChI=1S/C14H12ClN3/c15-9-4-5-11-10(6-9)13-12(7-16-11)17-14(18-13)8-2-1-3-8/h4-8H,1-3H2,(H,17,18)
InChIKeyHNJWQQIYXGLHSQ-UHFFFAOYSA-N
MW257.72 g/mol
LogP4.03
Rot. Bonds1

About 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline

8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline (PubChem CID 150449079) has the molecular formula C14H12ClN3 and a molecular weight of 257.72 g/mol. Its IUPAC name is 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline
PubChem CID150449079
Molecular FormulaC14H12ClN3
Molecular Weight257.72 g/mol
Exact Mass257.07
IUPAC Name8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline
SMILESClc1ccc2ncc3[nH]c(C4CCC4)nc3c2c1
InChIInChI=1S/C14H12ClN3/c15-9-4-5-11-10(6-9)13-12(7-16-11)17-14(18-13)8-2-1-3-8/h4-8H,1-3H2,(H,17,18)
InChIKeyHNJWQQIYXGLHSQ-UHFFFAOYSA-N
XLogP4.03
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline
CID 142423659
6-chloro-2-cyclohexyl-1H-imidazo[4,5-b]pyridine
CID 82142257
8-chloro-2-[(1-methylpyrazol-3-yl)methyl]-3H-imidazo[4,5-c]quinoline
CID 126712421
9-chloro-2-cyclobutyl-[1,2,4]triazolo[1,5-c]quinazoline
CID 91653372
2-[1-(cyclopropylmethyl)-6-oxopiperidin-3-yl]-3H-imidazo[4,5-c]quinoline-8-carbonitrile
CID 170583020
5,6-dichloro-2-cycloheptyl-1H-benzimidazole
CID 82004587
6-chloro-N-cyclobutylquinazolin-4-amine
CID 13231187
8-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3H-imidazo[4,5-c]quinoline
CID 126712422
2-[(8-chloro-3H-imidazo[4,5-c]quinolin-2-yl)methyl]pyrido[1,2-a]pyrimidin-4-one
CID 126712424
3,6-dichloro-4-piperazin-1-ylquinoline
CID 121236121
8-chloro-2-(trifluoromethyl)-5H-pyrimido[5,4-b]indole
CID 118626928
3-(6-chloro-1H-benzimidazol-2-yl)-N-(4-chlorophenyl)piperidine-1-carbothioamide
CID 3223996

Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline?
The IUPAC name of 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline (CID 150449079) is 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline.
What is the SMILES notation for 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline?
The canonical SMILES for 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline is Clc1ccc2ncc3[nH]c(C4CCC4)nc3c2c1.
What is the InChIKey of 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline?
The InChIKey is HNJWQQIYXGLHSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3/c15-9-4-5-11-10(6-9)13-12(7-16-11)17-14(18-13)8-2-1-3-8/h4-8H,1-3H2,(H,17,18).
What are the key properties of 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline?
8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline has a molecular weight of 257.72 g/mol, XLogP of 4.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline is sourced from PubChem (CID 150449079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).