2-piperidin-1-yl-1,4-dihydropyrimidine

C9H15N3 — CID 142973102

IUPAC2-piperidin-1-yl-1,4-dihydropyrimidine
SMILESC1=CNC(N2CCCCC2)=NC1
InChIInChI=1S/C9H15N3/c1-2-7-12(8-3-1)9-10-5-4-6-11-9/h4-5H,1-3,6-8H2,(H,10,11)
InChIKeyWSWYLCVPLKLILO-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.95
Rot. Bonds

About 2-piperidin-1-yl-1,4-dihydropyrimidine

2-piperidin-1-yl-1,4-dihydropyrimidine (PubChem CID 142973102) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-piperidin-1-yl-1,4-dihydropyrimidine.

Molecular Properties

Compound Name2-piperidin-1-yl-1,4-dihydropyrimidine
PubChem CID142973102
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name2-piperidin-1-yl-1,4-dihydropyrimidine
SMILESC1=CNC(N2CCCCC2)=NC1
InChIInChI=1S/C9H15N3/c1-2-7-12(8-3-1)9-10-5-4-6-11-9/h4-5H,1-3,6-8H2,(H,10,11)
InChIKeyWSWYLCVPLKLILO-UHFFFAOYSA-N
XLogP0.95
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-piperidin-1-yl-1,4-dihydropyrimidine 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-piperidin-1-yl-1,4-dihydropyrimidine?
The IUPAC name of 2-piperidin-1-yl-1,4-dihydropyrimidine (CID 142973102) is 2-piperidin-1-yl-1,4-dihydropyrimidine.
What is the SMILES notation for 2-piperidin-1-yl-1,4-dihydropyrimidine?
The canonical SMILES for 2-piperidin-1-yl-1,4-dihydropyrimidine is C1=CNC(N2CCCCC2)=NC1.
What is the InChIKey of 2-piperidin-1-yl-1,4-dihydropyrimidine?
The InChIKey is WSWYLCVPLKLILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-2-7-12(8-3-1)9-10-5-4-6-11-9/h4-5H,1-3,6-8H2,(H,10,11).
What are the key properties of 2-piperidin-1-yl-1,4-dihydropyrimidine?
2-piperidin-1-yl-1,4-dihydropyrimidine has a molecular weight of 165.24 g/mol, XLogP of 0.95, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-yl-1,4-dihydropyrimidine is sourced from PubChem (CID 142973102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).