3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one

C11H17N3O — CID 63794207

IUPAC3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one
SMILESO=c1ccncn1CCNC1CCCC1
InChIInChI=1S/C11H17N3O/c15-11-5-6-12-9-14(11)8-7-13-10-3-1-2-4-10/h5-6,9-10,13H,1-4,7-8H2
InChIKeyIGPKADOEYLBACV-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.78
Rot. Bonds4

About 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one

3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one (PubChem CID 63794207) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one.

Molecular Properties

Compound Name3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one
PubChem CID63794207
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one
SMILESO=c1ccncn1CCNC1CCCC1
InChIInChI=1S/C11H17N3O/c15-11-5-6-12-9-14(11)8-7-13-10-3-1-2-4-10/h5-6,9-10,13H,1-4,7-8H2
InChIKeyIGPKADOEYLBACV-UHFFFAOYSA-N
XLogP0.78
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[2-(cyclopentylamino)ethyl]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

Frequently Asked Questions

What is the IUPAC name of 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one?
The IUPAC name of 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one (CID 63794207) is 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one.
What is the SMILES notation for 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one?
The canonical SMILES for 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one is O=c1ccncn1CCNC1CCCC1.
What is the InChIKey of 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one?
The InChIKey is IGPKADOEYLBACV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c15-11-5-6-12-9-14(11)8-7-13-10-3-1-2-4-10/h5-6,9-10,13H,1-4,7-8H2.
What are the key properties of 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one?
3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one has a molecular weight of 207.28 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(cyclopentylamino)ethyl]pyrimidin-4-one is sourced from PubChem (CID 63794207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).