(2-chloro-3-pyridinyl)-phenylmethanol

C12H10ClNO — CID 3061980

IUPAC(2-chloro-3-pyridinyl)-phenylmethanol
SMILESOC(c1ccccc1)c1cccnc1Cl
InChIInChI=1S/C12H10ClNO/c13-12-10(7-4-8-14-12)11(15)9-5-2-1-3-6-9/h1-8,11,15H
InChIKeyDFZYQRVGTKIAOU-UHFFFAOYSA-N
MW219.67 g/mol
LogP2.82
Rot. Bonds2

About (2-chloro-3-pyridinyl)-phenylmethanol

(2-chloro-3-pyridinyl)-phenylmethanol (PubChem CID 3061980) has the molecular formula C12H10ClNO and a molecular weight of 219.67 g/mol. Its IUPAC name is (2-chloro-3-pyridinyl)-phenylmethanol.

Molecular Properties

Compound Name(2-chloro-3-pyridinyl)-phenylmethanol
PubChem CID3061980
Molecular FormulaC12H10ClNO
Molecular Weight219.67 g/mol
Exact Mass219.05
IUPAC Name(2-chloro-3-pyridinyl)-phenylmethanol
SMILESOC(c1ccccc1)c1cccnc1Cl
InChIInChI=1S/C12H10ClNO/c13-12-10(7-4-8-14-12)11(15)9-5-2-1-3-6-9/h1-8,11,15H
InChIKeyDFZYQRVGTKIAOU-UHFFFAOYSA-N
XLogP2.82
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.67
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (2-chloro-3-pyridinyl)-phenylmethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-chloro-3-pyridinyl)-phenylmethanol?
The IUPAC name of (2-chloro-3-pyridinyl)-phenylmethanol (CID 3061980) is (2-chloro-3-pyridinyl)-phenylmethanol.
What is the SMILES notation for (2-chloro-3-pyridinyl)-phenylmethanol?
The canonical SMILES for (2-chloro-3-pyridinyl)-phenylmethanol is OC(c1ccccc1)c1cccnc1Cl.
What is the InChIKey of (2-chloro-3-pyridinyl)-phenylmethanol?
The InChIKey is DFZYQRVGTKIAOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO/c13-12-10(7-4-8-14-12)11(15)9-5-2-1-3-6-9/h1-8,11,15H.
What are the key properties of (2-chloro-3-pyridinyl)-phenylmethanol?
(2-chloro-3-pyridinyl)-phenylmethanol has a molecular weight of 219.67 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-3-pyridinyl)-phenylmethanol is sourced from PubChem (CID 3061980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).