(4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol

C17H12ClN3O — CID 19804708

IUPAC(4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol
SMILESOC(c1ccc(Cl)cc1)c1nc2c(cnc3ccccc32)[nH]1
InChIInChI=1S/C17H12ClN3O/c18-11-7-5-10(6-8-11)16(22)17-20-14-9-19-13-4-2-1-3-12(13)15(14)21-17/h1-9,16,22H,(H,20,21)
InChIKeyRSZODAWNBKUNFT-UHFFFAOYSA-N
MW309.76 g/mol
LogP3.85
Rot. Bonds2

About (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol

(4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol (PubChem CID 19804708) has the molecular formula C17H12ClN3O and a molecular weight of 309.76 g/mol. Its IUPAC name is (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol.

Molecular Properties

Compound Name(4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol
PubChem CID19804708
Molecular FormulaC17H12ClN3O
Molecular Weight309.76 g/mol
Exact Mass309.07
IUPAC Name(4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol
SMILESOC(c1ccc(Cl)cc1)c1nc2c(cnc3ccccc32)[nH]1
InChIInChI=1S/C17H12ClN3O/c18-11-7-5-10(6-8-11)16(22)17-20-14-9-19-13-4-2-1-3-12(13)15(14)21-17/h1-9,16,22H,(H,20,21)
InChIKeyRSZODAWNBKUNFT-UHFFFAOYSA-N
XLogP3.85
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.76
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1H-benzimidazol-2-yl-(4-chlorophenyl)methanol
CID 21125
(S)-3H-benzo[e]benzimidazol-2-yl(phenyl)methanol
CID 125482110
(4-chlorophenyl)-quinolin-3-ylmethanol
CID 20794845
(R)-(6-bromo-1H-benzimidazol-2-yl)-(4-chlorophenyl)methanol
CID 125481020
[1-(3H-imidazo[4,5-c]quinolin-2-yl)-3-methylbutyl] acetate
CID 70024749
2-(1-piperidin-4-yloxyethyl)-3H-imidazo[4,5-c]quinoline
CID 123943298
1H-benzimidazol-2-yl-[4-(3-chloropyrazin-2-yl)oxyphenyl]methanol
CID 143998201
(4-chlorophenyl)-(2-methylquinolin-4-yl)methanol
CID 79234879
2-pyridin-4-yl-3H-imidazo[4,5-c]quinoline
CID 14207821
bis(1H-benzimidazol-2-yl)methanol
CID 3747179
3H-imidazo[4,5-c]quinolin-2-ylmethyl acetate
CID 69335263
(1R)-1-(4-chlorophenyl)-2-(quinoxalin-2-ylamino)ethanol
CID 38006311

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol?
The IUPAC name of (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol (CID 19804708) is (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol.
What is the SMILES notation for (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol?
The canonical SMILES for (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol is OC(c1ccc(Cl)cc1)c1nc2c(cnc3ccccc32)[nH]1.
What is the InChIKey of (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol?
The InChIKey is RSZODAWNBKUNFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClN3O/c18-11-7-5-10(6-8-11)16(22)17-20-14-9-19-13-4-2-1-3-12(13)15(14)21-17/h1-9,16,22H,(H,20,21).
What are the key properties of (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol?
(4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol has a molecular weight of 309.76 g/mol, XLogP of 3.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(3H-imidazo[4,5-c]quinolin-2-yl)methanol is sourced from PubChem (CID 19804708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).