2-(4-chlorophenyl)pyrimidin-5-ol

C10H7ClN2O — CID 59322178

IUPAC2-(4-chlorophenyl)pyrimidin-5-ol
SMILESOc1cnc(-c2ccc(Cl)cc2)nc1
InChIInChI=1S/C10H7ClN2O/c11-8-3-1-7(2-4-8)10-12-5-9(14)6-13-10/h1-6,14H
InChIKeyAGBPUVKVIOFCLH-UHFFFAOYSA-N
MW206.63 g/mol
LogP2.50
Rot. Bonds1

About 2-(4-chlorophenyl)pyrimidin-5-ol

2-(4-chlorophenyl)pyrimidin-5-ol (PubChem CID 59322178) has the molecular formula C10H7ClN2O and a molecular weight of 206.63 g/mol. Its IUPAC name is 2-(4-chlorophenyl)pyrimidin-5-ol.

Molecular Properties

Compound Name2-(4-chlorophenyl)pyrimidin-5-ol
PubChem CID59322178
Molecular FormulaC10H7ClN2O
Molecular Weight206.63 g/mol
Exact Mass206.02
IUPAC Name2-(4-chlorophenyl)pyrimidin-5-ol
SMILESOc1cnc(-c2ccc(Cl)cc2)nc1
InChIInChI=1S/C10H7ClN2O/c11-8-3-1-7(2-4-8)10-12-5-9(14)6-13-10/h1-6,14H
InChIKeyAGBPUVKVIOFCLH-UHFFFAOYSA-N
XLogP2.50
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.63
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)pyrimidin-5-ol?
The IUPAC name of 2-(4-chlorophenyl)pyrimidin-5-ol (CID 59322178) is 2-(4-chlorophenyl)pyrimidin-5-ol.
What is the SMILES notation for 2-(4-chlorophenyl)pyrimidin-5-ol?
The canonical SMILES for 2-(4-chlorophenyl)pyrimidin-5-ol is Oc1cnc(-c2ccc(Cl)cc2)nc1.
What is the InChIKey of 2-(4-chlorophenyl)pyrimidin-5-ol?
The InChIKey is AGBPUVKVIOFCLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN2O/c11-8-3-1-7(2-4-8)10-12-5-9(14)6-13-10/h1-6,14H.
What are the key properties of 2-(4-chlorophenyl)pyrimidin-5-ol?
2-(4-chlorophenyl)pyrimidin-5-ol has a molecular weight of 206.63 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)pyrimidin-5-ol is sourced from PubChem (CID 59322178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).