[2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine

C12H19N3O — CID 83189535

IUPAC[2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine
SMILESCc1nc(OCC2CCCC2)ncc1CN
InChIInChI=1S/C12H19N3O/c1-9-11(6-13)7-14-12(15-9)16-8-10-4-2-3-5-10/h7,10H,2-6,8,13H2,1H3
InChIKeyNPDXQLQICZWQND-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.81
Rot. Bonds4

About [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine

[2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine (PubChem CID 83189535) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine.

Molecular Properties

Compound Name[2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine
PubChem CID83189535
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine
SMILESCc1nc(OCC2CCCC2)ncc1CN
InChIInChI=1S/C12H19N3O/c1-9-11(6-13)7-14-12(15-9)16-8-10-4-2-3-5-10/h7,10H,2-6,8,13H2,1H3
InChIKeyNPDXQLQICZWQND-UHFFFAOYSA-N
XLogP1.81
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine 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 [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine?
The IUPAC name of [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine (CID 83189535) is [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine.
What is the SMILES notation for [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine?
The canonical SMILES for [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine is Cc1nc(OCC2CCCC2)ncc1CN.
What is the InChIKey of [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine?
The InChIKey is NPDXQLQICZWQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-11(6-13)7-14-12(15-9)16-8-10-4-2-3-5-10/h7,10H,2-6,8,13H2,1H3.
What are the key properties of [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine?
[2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine has a molecular weight of 221.30 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine is sourced from PubChem (CID 83189535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).