(4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol

C19H16ClNO — CID 56672766

IUPAC(4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol
SMILESCc1ccccc1C(O)(c1ccc(Cl)cc1)c1cccnc1
InChIInChI=1S/C19H16ClNO/c1-14-5-2-3-7-18(14)19(22,16-6-4-12-21-13-16)15-8-10-17(20)11-9-15/h2-13,22H,1H3
InChIKeyJKRHCXSPUYBSBH-UHFFFAOYSA-N
MW309.80 g/mol
LogP4.33
Rot. Bonds3

About (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol

(4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol (PubChem CID 56672766) has the molecular formula C19H16ClNO and a molecular weight of 309.80 g/mol. Its IUPAC name is (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol
PubChem CID56672766
Molecular FormulaC19H16ClNO
Molecular Weight309.80 g/mol
Exact Mass309.09
IUPAC Name(4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol
SMILESCc1ccccc1C(O)(c1ccc(Cl)cc1)c1cccnc1
InChIInChI=1S/C19H16ClNO/c1-14-5-2-3-7-18(14)19(22,16-6-4-12-21-13-16)15-8-10-17(20)11-9-15/h2-13,22H,1H3
InChIKeyJKRHCXSPUYBSBH-UHFFFAOYSA-N
XLogP4.33
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol?
The IUPAC name of (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol (CID 56672766) is (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol.
What is the SMILES notation for (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol?
The canonical SMILES for (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol is Cc1ccccc1C(O)(c1ccc(Cl)cc1)c1cccnc1.
What is the InChIKey of (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol?
The InChIKey is JKRHCXSPUYBSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNO/c1-14-5-2-3-7-18(14)19(22,16-6-4-12-21-13-16)15-8-10-17(20)11-9-15/h2-13,22H,1H3.
What are the key properties of (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol?
(4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol has a molecular weight of 309.80 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(2-methylphenyl)-pyridin-3-ylmethanol is sourced from PubChem (CID 56672766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).