(3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol

C15H16ClNO2 — CID 103443462

IUPAC(3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol
SMILESCOc1c(C(O)c2ncccc2Cl)ccc(C)c1C
InChIInChI=1S/C15H16ClNO2/c1-9-6-7-11(15(19-3)10(9)2)14(18)13-12(16)5-4-8-17-13/h4-8,14,18H,1-3H3
InChIKeyKTDNDFFDBXNFLL-UHFFFAOYSA-N
MW277.75 g/mol
LogP3.44
Rot. Bonds3

About (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol

(3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol (PubChem CID 103443462) has the molecular formula C15H16ClNO2 and a molecular weight of 277.75 g/mol. Its IUPAC name is (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol.

Molecular Properties

Compound Name(3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol
PubChem CID103443462
Molecular FormulaC15H16ClNO2
Molecular Weight277.75 g/mol
Exact Mass277.09
IUPAC Name(3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol
SMILESCOc1c(C(O)c2ncccc2Cl)ccc(C)c1C
InChIInChI=1S/C15H16ClNO2/c1-9-6-7-11(15(19-3)10(9)2)14(18)13-12(16)5-4-8-17-13/h4-8,14,18H,1-3H3
InChIKeyKTDNDFFDBXNFLL-UHFFFAOYSA-N
XLogP3.44
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.75
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methoxy-3,4-dimethylphenyl)-(3-methyl-2-pyridinyl)methanol
CID 103433103
(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432506
(3-chloro-4-methylphenyl)-(3-chloro-2-pyridinyl)methanol
CID 107560175
(3-chloro-2-pyridinyl)-(2-methylthiophen-3-yl)methanol
CID 103443385
2-(2-chlorophenyl)-1-(2-methoxy-3,4-dimethylphenyl)ethanamine
CID 103433437
(3-bromo-4-chlorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432694
(2-fluoro-3-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103435754
(2-amino-4-chlorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103433130
(2-methoxy-3,4-dimethylphenyl)-(2,4,6-trimethylphenyl)methanol
CID 103432508
(4-methoxy-2-methylphenyl)-(3-methyl-2-pyridinyl)methanol
CID 65313144
(3,5-dibromophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 107978788
(2-methoxy-3,4-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 103435788

Frequently Asked Questions

What is the IUPAC name of (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The IUPAC name of (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol (CID 103443462) is (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol.
What is the SMILES notation for (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The canonical SMILES for (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol is COc1c(C(O)c2ncccc2Cl)ccc(C)c1C.
What is the InChIKey of (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The InChIKey is KTDNDFFDBXNFLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO2/c1-9-6-7-11(15(19-3)10(9)2)14(18)13-12(16)5-4-8-17-13/h4-8,14,18H,1-3H3.
What are the key properties of (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
(3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol has a molecular weight of 277.75 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol is sourced from PubChem (CID 103443462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).