4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol

C11H15ClN2O — CID 14196532

IUPAC4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol
SMILESCc1nc(Cl)c(O)c(C2CCCCC2)n1
InChIInChI=1S/C11H15ClN2O/c1-7-13-9(10(15)11(12)14-7)8-5-3-2-4-6-8/h8,15H,2-6H2,1H3
InChIKeyPGSZCPYNNOAUAA-UHFFFAOYSA-N
MW226.71 g/mol
LogP3.19
Rot. Bonds1

About 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol

4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol (PubChem CID 14196532) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol.

Molecular Properties

Compound Name4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol
PubChem CID14196532
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC Name4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol
SMILESCc1nc(Cl)c(O)c(C2CCCCC2)n1
InChIInChI=1S/C11H15ClN2O/c1-7-13-9(10(15)11(12)14-7)8-5-3-2-4-6-8/h8,15H,2-6H2,1H3
InChIKeyPGSZCPYNNOAUAA-UHFFFAOYSA-N
XLogP3.19
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-(4-chloro-6-cyclopropyl-2-methylpyrimidin-5-yl)-3-oxopropanoate
CID 82667326
6-chloro-N-cyclohexyl-2,5-dimethylpyrimidin-4-amine
CID 63736474
5,7-dichloro-2,3-di(cyclooctyl)-6-methylpyrazolo[1,5-a]pyrimidine
CID 134320105
2-chloro-4-cyclohexyl-6-methylpyridine
CID 83702773
4-cyclopropyl-2,5,6-trimethylpyrimidine
CID 163258333
6-chloro-N-(cyclohexylmethyl)-2,5-dimethylpyrimidin-4-amine
CID 63729418
methyl 4-chloro-2-methyl-5,6,7,8-tetrahydroquinazoline-8-carboxylate
CID 115043971
6-cyclopentyl-3-methyl-1,2,4-triazin-5-amine
CID 116823527
4-cyclopropyl-6-fluoro-5-iodo-2-methylpyrimidine
CID 164652186
4,6-dichloro-2-cycloheptyl-5-cyclopentylpyrimidine
CID 115926469
4-chloro-2-cyclooctyl-5-ethyl-6-methylpyrimidine
CID 80602537
4-cyclobutyl-6-methoxy-2-methylpyrimidine-5-carboxylic acid
CID 82392231

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol?
The IUPAC name of 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol (CID 14196532) is 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol.
What is the SMILES notation for 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol?
The canonical SMILES for 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol is Cc1nc(Cl)c(O)c(C2CCCCC2)n1.
What is the InChIKey of 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol?
The InChIKey is PGSZCPYNNOAUAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c1-7-13-9(10(15)11(12)14-7)8-5-3-2-4-6-8/h8,15H,2-6H2,1H3.
What are the key properties of 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol?
4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol has a molecular weight of 226.71 g/mol, XLogP of 3.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-cyclohexyl-2-methylpyrimidin-5-ol is sourced from PubChem (CID 14196532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).