(4-cyclopentylpyrimidin-2-yl)methanol

C10H14N2O — CID 116899510

IUPAC(4-cyclopentylpyrimidin-2-yl)methanol
SMILESOCc1nccc(C2CCCC2)n1
InChIInChI=1S/C10H14N2O/c13-7-10-11-6-5-9(12-10)8-3-1-2-4-8/h5-6,8,13H,1-4,7H2
InChIKeyAQKJBBXINXDOCK-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.63
Rot. Bonds2

About (4-cyclopentylpyrimidin-2-yl)methanol

(4-cyclopentylpyrimidin-2-yl)methanol (PubChem CID 116899510) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is (4-cyclopentylpyrimidin-2-yl)methanol.

Molecular Properties

Compound Name(4-cyclopentylpyrimidin-2-yl)methanol
PubChem CID116899510
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name(4-cyclopentylpyrimidin-2-yl)methanol
SMILESOCc1nccc(C2CCCC2)n1
InChIInChI=1S/C10H14N2O/c13-7-10-11-6-5-9(12-10)8-3-1-2-4-8/h5-6,8,13H,1-4,7H2
InChIKeyAQKJBBXINXDOCK-UHFFFAOYSA-N
XLogP1.63
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-cyclohexylpyrimidin-2-yl)ethanol
CID 116899631
N-[(4-cyclohexylpyrimidin-2-yl)methyl]propan-2-amine
CID 63318874
2-amino-3-(4-cyclohexylpyrimidin-2-yl)propanoic acid
CID 116902314
4-(4-cyclobutylpyrimidin-2-yl)butan-2-one
CID 116901689
2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol
CID 116899632
3-(4-cyclobutylpyrimidin-2-yl)-N-methylpropan-1-amine
CID 116898181
4-cyclopropyl-2-(2-methylpropyl)pyrimidine
CID 70659268
N-[(4-cyclopropylpyrimidin-2-yl)methyl]cyclopropanamine
CID 63318876
4-cyclopentyl-2-methylsulfanylpyrimidine
CID 70073291
2-(4-cyclohexylpyrimidin-2-yl)-2-methylpropanoic acid
CID 116899904
4-(4-cyclopentylpyrimidin-2-yl)benzoic acid
CID 116900125
[4-(oxolan-3-yl)pyrimidin-2-yl]methanamine
CID 105469286

Frequently Asked Questions

What is the IUPAC name of (4-cyclopentylpyrimidin-2-yl)methanol?
The IUPAC name of (4-cyclopentylpyrimidin-2-yl)methanol (CID 116899510) is (4-cyclopentylpyrimidin-2-yl)methanol.
What is the SMILES notation for (4-cyclopentylpyrimidin-2-yl)methanol?
The canonical SMILES for (4-cyclopentylpyrimidin-2-yl)methanol is OCc1nccc(C2CCCC2)n1.
What is the InChIKey of (4-cyclopentylpyrimidin-2-yl)methanol?
The InChIKey is AQKJBBXINXDOCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c13-7-10-11-6-5-9(12-10)8-3-1-2-4-8/h5-6,8,13H,1-4,7H2.
What are the key properties of (4-cyclopentylpyrimidin-2-yl)methanol?
(4-cyclopentylpyrimidin-2-yl)methanol has a molecular weight of 178.24 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopentylpyrimidin-2-yl)methanol is sourced from PubChem (CID 116899510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).