(2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol

C14H13Cl2NO — CID 167910776

IUPAC(2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol
SMILESCc1ccc(C(O)c2ccc(Cl)cc2Cl)c(C)n1
InChIInChI=1S/C14H13Cl2NO/c1-8-3-5-11(9(2)17-8)14(18)12-6-4-10(15)7-13(12)16/h3-7,14,18H,1-2H3
InChIKeyYTWMLQJXYNUYDQ-UHFFFAOYSA-N
MW282.17 g/mol
LogP4.09
Rot. Bonds2

About (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol

(2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol (PubChem CID 167910776) has the molecular formula C14H13Cl2NO and a molecular weight of 282.17 g/mol. Its IUPAC name is (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol
PubChem CID167910776
Molecular FormulaC14H13Cl2NO
Molecular Weight282.17 g/mol
Exact Mass281.04
IUPAC Name(2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol
SMILESCc1ccc(C(O)c2ccc(Cl)cc2Cl)c(C)n1
InChIInChI=1S/C14H13Cl2NO/c1-8-3-5-11(9(2)17-8)14(18)12-6-4-10(15)7-13(12)16/h3-7,14,18H,1-2H3
InChIKeyYTWMLQJXYNUYDQ-UHFFFAOYSA-N
XLogP4.09
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.17
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

bis(2,6-dimethyl-3-pyridinyl)methanol
CID 141423650
(2,4-dichlorophenyl)-(6-methyl-2-pyridinyl)methanol
CID 114281098
(2,4-dimethylphenyl)-(2,6-dimethyl-3-pyridinyl)methanol
CID 115604805
(2,4-dichlorophenyl)-(3-methylpyrazin-2-yl)methanol
CID 166243334
(2,6-dimethyl-3-pyridinyl)-(4-propan-2-ylphenyl)methanol
CID 115604819
(2,4-dichlorophenyl)-(2-methyl-1H-pyrrol-3-yl)methanol
CID 57098054
(2,4-dichlorophenyl)-(2,5-dimethylfuran-3-yl)methanol
CID 61270452
(2,4-dichlorophenyl)-(4-methyl-1,3-thiazol-5-yl)methanol
CID 22101852
(2,4-dichlorophenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 63426938
1-(2,6-dimethyl-3-pyridinyl)-2-methylpropan-1-ol
CID 105133610
(2,6-dimethyl-3-pyridinyl)-phenylmethanol
CID 115604798
(3-chloro-2-fluorophenyl)-(2,4-dichlorophenyl)methanol
CID 81266328

Frequently Asked Questions

What is the IUPAC name of (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol?
The IUPAC name of (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol (CID 167910776) is (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol.
What is the SMILES notation for (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol?
The canonical SMILES for (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol is Cc1ccc(C(O)c2ccc(Cl)cc2Cl)c(C)n1.
What is the InChIKey of (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol?
The InChIKey is YTWMLQJXYNUYDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO/c1-8-3-5-11(9(2)17-8)14(18)12-6-4-10(15)7-13(12)16/h3-7,14,18H,1-2H3.
What are the key properties of (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol?
(2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol has a molecular weight of 282.17 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanol is sourced from PubChem (CID 167910776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).