(4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol

C19H16ClNO2 — CID 56679206

IUPAC(4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol
SMILESCOc1cccc(C(O)(c2ccc(Cl)cc2)c2cccnc2)c1
InChIInChI=1S/C19H16ClNO2/c1-23-18-6-2-4-15(12-18)19(22,16-5-3-11-21-13-16)14-7-9-17(20)10-8-14/h2-13,22H,1H3
InChIKeyNEOXVVWHXSTNLW-UHFFFAOYSA-N
MW325.80 g/mol
LogP4.03
Rot. Bonds4

About (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol

(4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol (PubChem CID 56679206) has the molecular formula C19H16ClNO2 and a molecular weight of 325.80 g/mol. Its IUPAC name is (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol
PubChem CID56679206
Molecular FormulaC19H16ClNO2
Molecular Weight325.80 g/mol
Exact Mass325.09
IUPAC Name(4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol
SMILESCOc1cccc(C(O)(c2ccc(Cl)cc2)c2cccnc2)c1
InChIInChI=1S/C19H16ClNO2/c1-23-18-6-2-4-15(12-18)19(22,16-5-3-11-21-13-16)14-7-9-17(20)10-8-14/h2-13,22H,1H3
InChIKeyNEOXVVWHXSTNLW-UHFFFAOYSA-N
XLogP4.03
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.80
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol?
The IUPAC name of (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol (CID 56679206) is (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol.
What is the SMILES notation for (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol?
The canonical SMILES for (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol is COc1cccc(C(O)(c2ccc(Cl)cc2)c2cccnc2)c1.
What is the InChIKey of (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol?
The InChIKey is NEOXVVWHXSTNLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNO2/c1-23-18-6-2-4-15(12-18)19(22,16-5-3-11-21-13-16)14-7-9-17(20)10-8-14/h2-13,22H,1H3.
What are the key properties of (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol?
(4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol has a molecular weight of 325.80 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(3-methoxyphenyl)-pyridin-3-ylmethanol is sourced from PubChem (CID 56679206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).