8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline

C15H14ClN3O — CID 142423659

IUPAC8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline
SMILESCOC1CC(c2nc3c(cnc4ccc(Cl)cc43)[nH]2)C1
InChIInChI=1S/C15H14ClN3O/c1-20-10-4-8(5-10)15-18-13-7-17-12-3-2-9(16)6-11(12)14(13)19-15/h2-3,6-8,10H,4-5H2,1H3,(H,18,19)
InChIKeyVTJRTIGPXNDHFN-UHFFFAOYSA-N
MW287.75 g/mol
LogP3.66
Rot. Bonds2

About 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline

8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline (PubChem CID 142423659) has the molecular formula C15H14ClN3O and a molecular weight of 287.75 g/mol. Its IUPAC name is 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline
PubChem CID142423659
Molecular FormulaC15H14ClN3O
Molecular Weight287.75 g/mol
Exact Mass287.08
IUPAC Name8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline
SMILESCOC1CC(c2nc3c(cnc4ccc(Cl)cc43)[nH]2)C1
InChIInChI=1S/C15H14ClN3O/c1-20-10-4-8(5-10)15-18-13-7-17-12-3-2-9(16)6-11(12)14(13)19-15/h2-3,6-8,10H,4-5H2,1H3,(H,18,19)
InChIKeyVTJRTIGPXNDHFN-UHFFFAOYSA-N
XLogP3.66
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-chloro-2-cyclobutyl-3H-imidazo[4,5-c]quinoline
CID 150449079
8-chloro-2-[(1-methylpyrazol-3-yl)methyl]-3H-imidazo[4,5-c]quinoline
CID 126712421
6-chloro-2-(2-methylcyclopropyl)-1H-benzimidazole
CID 60648934
9-chloro-2,3-dimethylbenzo[h][1,6]naphthyridine
CID 53242883
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
8-chloro-2-(trifluoromethyl)-5H-pyrimido[5,4-b]indole
CID 118626928
3,6-dichloro-4-piperazin-1-ylquinoline
CID 121236121
2-[1-(cyclopropylmethyl)-6-oxopiperidin-3-yl]-3H-imidazo[4,5-c]quinoline-8-carbonitrile
CID 170583020
7,8-dimethoxy-2-methyl-3H-imidazo[4,5-c]quinoline
CID 156713420
6-chloro-2-[[(2S,4R)-4-methoxy-2-(1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methyl]-1-methylbenzimidazole
CID 167984235
6-chloro-2-[1-(3-piperidin-1-ylpyrazin-2-yl)azetidin-3-yl]-1H-benzimidazole
CID 54670983

Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline?
The IUPAC name of 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline (CID 142423659) is 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline.
What is the SMILES notation for 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline?
The canonical SMILES for 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline is COC1CC(c2nc3c(cnc4ccc(Cl)cc43)[nH]2)C1.
What is the InChIKey of 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline?
The InChIKey is VTJRTIGPXNDHFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O/c1-20-10-4-8(5-10)15-18-13-7-17-12-3-2-9(16)6-11(12)14(13)19-15/h2-3,6-8,10H,4-5H2,1H3,(H,18,19).
What are the key properties of 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline?
8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline has a molecular weight of 287.75 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2-(3-methoxycyclobutyl)-3H-imidazo[4,5-c]quinoline is sourced from PubChem (CID 142423659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).