(4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol

C14H14ClNO — CID 113365542

IUPAC(4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol
SMILESCc1cnc(C(O)c2ccc(Cl)cc2)c(C)c1
InChIInChI=1S/C14H14ClNO/c1-9-7-10(2)13(16-8-9)14(17)11-3-5-12(15)6-4-11/h3-8,14,17H,1-2H3
InChIKeyZSDUVMHVPYARDP-UHFFFAOYSA-N
MW247.72 g/mol
LogP3.43
Rot. Bonds2

About (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol

(4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol (PubChem CID 113365542) has the molecular formula C14H14ClNO and a molecular weight of 247.72 g/mol. Its IUPAC name is (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol.

Molecular Properties

Compound Name(4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol
PubChem CID113365542
Molecular FormulaC14H14ClNO
Molecular Weight247.72 g/mol
Exact Mass247.08
IUPAC Name(4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol
SMILESCc1cnc(C(O)c2ccc(Cl)cc2)c(C)c1
InChIInChI=1S/C14H14ClNO/c1-9-7-10(2)13(16-8-9)14(17)11-3-5-12(15)6-4-11/h3-8,14,17H,1-2H3
InChIKeyZSDUVMHVPYARDP-UHFFFAOYSA-N
XLogP3.43
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.72
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3,4-dimethylphenyl)-(3,5-dimethyl-2-pyridinyl)methanol
CID 113365534
(3,5-dimethyl-2-pyridinyl)-(3-propylphenyl)methanol
CID 116543803
(4-bromo-3-chloro-2-fluorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol
CID 106762147
(3-cyclobutylphenyl)-(3,5-dimethyl-2-pyridinyl)methanol
CID 114602448
(4-chlorophenyl)-(5-methylthieno[2,3-d]pyrimidin-4-yl)methanol
CID 70909626
1-(3,5-dimethyl-2-pyridinyl)ethane-1,2-diol
CID 169267261
2-(4-chloro-2-fluorophenyl)-1-(3,5-dimethyl-2-pyridinyl)ethanamine
CID 114856908
[(3,5-dimethyl-2-pyridinyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 105266471
2-chloro-3,5-dimethylpyridine;hydrochloride
CID 174570107
(3,5-dimethyl-2-pyridinyl)-(1-ethylimidazol-2-yl)methanol
CID 113365556
(3,5-dichloro-2-pyridinyl)-(3,4-difluorophenyl)methanol
CID 79780694
(2-bromo-4,5-dimethylphenyl)-(4-chlorophenyl)methanol
CID 139494105

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol?
The IUPAC name of (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol (CID 113365542) is (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol.
What is the SMILES notation for (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol?
The canonical SMILES for (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol is Cc1cnc(C(O)c2ccc(Cl)cc2)c(C)c1.
What is the InChIKey of (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol?
The InChIKey is ZSDUVMHVPYARDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO/c1-9-7-10(2)13(16-8-9)14(17)11-3-5-12(15)6-4-11/h3-8,14,17H,1-2H3.
What are the key properties of (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol?
(4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol has a molecular weight of 247.72 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(3,5-dimethyl-2-pyridinyl)methanol is sourced from PubChem (CID 113365542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).