3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one

C11H17N3O — CID 104747715

IUPAC3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one
SMILESNC(Cn1cnccc1=O)C1CCCC1
InChIInChI=1S/C11H17N3O/c12-10(9-3-1-2-4-9)7-14-8-13-6-5-11(14)15/h5-6,8-10H,1-4,7,12H2
InChIKeyGKELEYICQBUOLE-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.76
Rot. Bonds3

About 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one

3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one (PubChem CID 104747715) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one.

Molecular Properties

Compound Name3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one
PubChem CID104747715
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one
SMILESNC(Cn1cnccc1=O)C1CCCC1
InChIInChI=1S/C11H17N3O/c12-10(9-3-1-2-4-9)7-14-8-13-6-5-11(14)15/h5-6,8-10H,1-4,7,12H2
InChIKeyGKELEYICQBUOLE-UHFFFAOYSA-N
XLogP0.76
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one 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

3-[2-(5-Methylhexan-2-ylamino)ethyl]pyrimidin-4-one
CID 55236850
3-[2-(Cyclopentylmethylamino)ethyl]-6-methylpyrimidin-4-one
CID 62564458
3-(3-Pyrrolidin-2-ylpropyl)pyrimidin-4-one
CID 63769528
3-(2-Piperidin-3-ylethyl)pyrimidin-4-one
CID 63769703
3-[2-[(2-Methylcyclohexyl)amino]ethyl]pyrimidin-4-one
CID 63793852
3-[2-(1-Cyclopropylethylamino)ethyl]pyrimidin-4-one
CID 63794206
3-[2-(Cyclopentylamino)ethyl]pyrimidin-4-one
CID 63794207
3-[2-(Cycloheptylamino)ethyl]pyrimidin-4-one
CID 63794208
3-[2-(Dicyclopropylmethylamino)ethyl]pyrimidin-4-one
CID 63794563
3-[2-[(3-Methylcyclohexyl)amino]ethyl]pyrimidin-4-one
CID 63794564
3-[2-[(4-Methylcyclohexyl)amino]ethyl]pyrimidin-4-one
CID 63795262
3-[2-(Cyclohexylmethylamino)ethyl]pyrimidin-4-one
CID 63795264

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one?
The IUPAC name of 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one (CID 104747715) is 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one.
What is the SMILES notation for 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one?
The canonical SMILES for 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one is NC(Cn1cnccc1=O)C1CCCC1.
What is the InChIKey of 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one?
The InChIKey is GKELEYICQBUOLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c12-10(9-3-1-2-4-9)7-14-8-13-6-5-11(14)15/h5-6,8-10H,1-4,7,12H2.
What are the key properties of 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one?
3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one has a molecular weight of 207.28 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-2-cyclopentylethyl)pyrimidin-4-one is sourced from PubChem (CID 104747715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).