3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide

C15H21N5O2 — CID 70746546

IUPAC3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide
SMILESNC(=O)N1CCCC(C(=O)NCc2ncc3c(n2)CCC3)C1
InChIInChI=1S/C15H21N5O2/c16-15(22)20-6-2-4-11(9-20)14(21)18-8-13-17-7-10-3-1-5-12(10)19-13/h7,11H,1-6,8-9H2,(H2,16,22)(H,18,21)
InChIKeyQGQXVPAMDJIWGI-UHFFFAOYSA-N
MW303.37 g/mol
LogP0.37
Rot. Bonds3

About 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide

3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide (PubChem CID 70746546) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide
PubChem CID70746546
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide
SMILESNC(=O)N1CCCC(C(=O)NCc2ncc3c(n2)CCC3)C1
InChIInChI=1S/C15H21N5O2/c16-15(22)20-6-2-4-11(9-20)14(21)18-8-13-17-7-10-3-1-5-12(10)19-13/h7,11H,1-6,8-9H2,(H2,16,22)(H,18,21)
InChIKeyQGQXVPAMDJIWGI-UHFFFAOYSA-N
XLogP0.37
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide 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-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide?
The IUPAC name of 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide (CID 70746546) is 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide?
The canonical SMILES for 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide is NC(=O)N1CCCC(C(=O)NCc2ncc3c(n2)CCC3)C1.
What is the InChIKey of 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide?
The InChIKey is QGQXVPAMDJIWGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c16-15(22)20-6-2-4-11(9-20)14(21)18-8-13-17-7-10-3-1-5-12(10)19-13/h7,11H,1-6,8-9H2,(H2,16,22)(H,18,21).
What are the key properties of 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide?
3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide has a molecular weight of 303.37 g/mol, XLogP of 0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)piperidine-1,3-dicarboxamide is sourced from PubChem (CID 70746546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).