2-chloro-4-(6-methyl-2-pyridinyl)phenol

C12H10ClNO — CID 136929172

IUPAC2-chloro-4-(6-methyl-2-pyridinyl)phenol
SMILESCc1cccc(-c2ccc(O)c(Cl)c2)n1
InChIInChI=1S/C12H10ClNO/c1-8-3-2-4-11(14-8)9-5-6-12(15)10(13)7-9/h2-7,15H,1H3
InChIKeyBTQDINHVNHNSPK-UHFFFAOYSA-N
MW219.67 g/mol
LogP3.42
Rot. Bonds1

About 2-chloro-4-(6-methyl-2-pyridinyl)phenol

2-chloro-4-(6-methyl-2-pyridinyl)phenol (PubChem CID 136929172) has the molecular formula C12H10ClNO and a molecular weight of 219.67 g/mol. Its IUPAC name is 2-chloro-4-(6-methyl-2-pyridinyl)phenol.

Molecular Properties

Compound Name2-chloro-4-(6-methyl-2-pyridinyl)phenol
PubChem CID136929172
Molecular FormulaC12H10ClNO
Molecular Weight219.67 g/mol
Exact Mass219.05
IUPAC Name2-chloro-4-(6-methyl-2-pyridinyl)phenol
SMILESCc1cccc(-c2ccc(O)c(Cl)c2)n1
InChIInChI=1S/C12H10ClNO/c1-8-3-2-4-11(14-8)9-5-6-12(15)10(13)7-9/h2-7,15H,1H3
InChIKeyBTQDINHVNHNSPK-UHFFFAOYSA-N
XLogP3.42
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.67
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(6-methyl-2-pyridinyl)phenol?
The IUPAC name of 2-chloro-4-(6-methyl-2-pyridinyl)phenol (CID 136929172) is 2-chloro-4-(6-methyl-2-pyridinyl)phenol.
What is the SMILES notation for 2-chloro-4-(6-methyl-2-pyridinyl)phenol?
The canonical SMILES for 2-chloro-4-(6-methyl-2-pyridinyl)phenol is Cc1cccc(-c2ccc(O)c(Cl)c2)n1.
What is the InChIKey of 2-chloro-4-(6-methyl-2-pyridinyl)phenol?
The InChIKey is BTQDINHVNHNSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO/c1-8-3-2-4-11(14-8)9-5-6-12(15)10(13)7-9/h2-7,15H,1H3.
What are the key properties of 2-chloro-4-(6-methyl-2-pyridinyl)phenol?
2-chloro-4-(6-methyl-2-pyridinyl)phenol has a molecular weight of 219.67 g/mol, XLogP of 3.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(6-methyl-2-pyridinyl)phenol is sourced from PubChem (CID 136929172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).