[2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol

C12H18N2O2 — CID 116778981

IUPAC[2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol
SMILESCCOC1(c2nccc(CO)n2)CCCC1
InChIInChI=1S/C12H18N2O2/c1-2-16-12(6-3-4-7-12)11-13-8-5-10(9-15)14-11/h5,8,15H,2-4,6-7,9H2,1H3
InChIKeyZRPSQFTVFBLGMB-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.77
Rot. Bonds4

About [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol

[2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol (PubChem CID 116778981) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol.

Molecular Properties

Compound Name[2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol
PubChem CID116778981
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name[2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol
SMILESCCOC1(c2nccc(CO)n2)CCCC1
InChIInChI=1S/C12H18N2O2/c1-2-16-12(6-3-4-7-12)11-13-8-5-10(9-15)14-11/h5,8,15H,2-4,6-7,9H2,1H3
InChIKeyZRPSQFTVFBLGMB-UHFFFAOYSA-N
XLogP1.77
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol with MolForge

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

Launch Full Analysis

Related Compounds

N-[[2-(1-ethoxycycloheptyl)pyrimidin-4-yl]methyl]ethanamine
CID 116778500
1-[2-(1-ethoxycycloheptyl)pyrimidin-4-yl]-N-methylmethanamine
CID 116778481
2-(1-ethoxycyclopentyl)pyrimidin-4-amine
CID 116775700
N-[[2-(1-ethoxycyclohexyl)pyrimidin-4-yl]methyl]propan-2-amine
CID 116778526
[2-(1-ethoxycyclopentyl)pyrimidin-4-yl]hydrazine
CID 116777611
2-(1-ethoxycyclohexyl)-N-propylpyrimidin-4-amine
CID 116776076
2-[2-(1-ethoxy-4-methylcyclohexyl)pyrimidin-4-yl]ethanamine
CID 116779124
N-[[2-(1-ethoxy-4-methylcyclohexyl)pyrimidin-4-yl]methyl]propan-1-amine
CID 116778505
2-(4-ethoxyoxan-4-yl)-N-methylpyrimidin-4-amine
CID 116776039
[2-(1-ethoxy-4,4-dimethylcyclohexyl)pyrimidin-4-yl]hydrazine
CID 116777628
2-(1-ethoxycycloheptyl)-4-ethylpyrimidine-5-carboxylic acid
CID 116775102
N-[[2-(1-methoxycycloheptyl)pyrimidin-4-yl]methyl]propan-2-amine
CID 116778527

Frequently Asked Questions

What is the IUPAC name of [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol?
The IUPAC name of [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol (CID 116778981) is [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol.
What is the SMILES notation for [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol?
The canonical SMILES for [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol is CCOC1(c2nccc(CO)n2)CCCC1.
What is the InChIKey of [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol?
The InChIKey is ZRPSQFTVFBLGMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-2-16-12(6-3-4-7-12)11-13-8-5-10(9-15)14-11/h5,8,15H,2-4,6-7,9H2,1H3.
What are the key properties of [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol?
[2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol has a molecular weight of 222.29 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol is sourced from PubChem (CID 116778981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).