(2,4-dichloro-3-quinolin-2-ylphenyl)methanol

C16H11Cl2NO — CID 174860669

IUPAC(2,4-dichloro-3-quinolin-2-ylphenyl)methanol
SMILESOCc1ccc(Cl)c(-c2ccc3ccccc3n2)c1Cl
InChIInChI=1S/C16H11Cl2NO/c17-12-7-5-11(9-20)16(18)15(12)14-8-6-10-3-1-2-4-13(10)19-14/h1-8,20H,9H2
InChIKeyBHJLYZCKKMGJKM-UHFFFAOYSA-N
MW304.18 g/mol
LogP4.70
Rot. Bonds2

About (2,4-dichloro-3-quinolin-2-ylphenyl)methanol

(2,4-dichloro-3-quinolin-2-ylphenyl)methanol (PubChem CID 174860669) has the molecular formula C16H11Cl2NO and a molecular weight of 304.18 g/mol. Its IUPAC name is (2,4-dichloro-3-quinolin-2-ylphenyl)methanol.

Molecular Properties

Compound Name(2,4-dichloro-3-quinolin-2-ylphenyl)methanol
PubChem CID174860669
Molecular FormulaC16H11Cl2NO
Molecular Weight304.18 g/mol
Exact Mass303.02
IUPAC Name(2,4-dichloro-3-quinolin-2-ylphenyl)methanol
SMILESOCc1ccc(Cl)c(-c2ccc3ccccc3n2)c1Cl
InChIInChI=1S/C16H11Cl2NO/c17-12-7-5-11(9-20)16(18)15(12)14-8-6-10-3-1-2-4-13(10)19-14/h1-8,20H,9H2
InChIKeyBHJLYZCKKMGJKM-UHFFFAOYSA-N
XLogP4.70
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.18
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,4-dichloro-3-quinolin-2-ylphenyl)methanol?
The IUPAC name of (2,4-dichloro-3-quinolin-2-ylphenyl)methanol (CID 174860669) is (2,4-dichloro-3-quinolin-2-ylphenyl)methanol.
What is the SMILES notation for (2,4-dichloro-3-quinolin-2-ylphenyl)methanol?
The canonical SMILES for (2,4-dichloro-3-quinolin-2-ylphenyl)methanol is OCc1ccc(Cl)c(-c2ccc3ccccc3n2)c1Cl.
What is the InChIKey of (2,4-dichloro-3-quinolin-2-ylphenyl)methanol?
The InChIKey is BHJLYZCKKMGJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2NO/c17-12-7-5-11(9-20)16(18)15(12)14-8-6-10-3-1-2-4-13(10)19-14/h1-8,20H,9H2.
What are the key properties of (2,4-dichloro-3-quinolin-2-ylphenyl)methanol?
(2,4-dichloro-3-quinolin-2-ylphenyl)methanol has a molecular weight of 304.18 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichloro-3-quinolin-2-ylphenyl)methanol is sourced from PubChem (CID 174860669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).