5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one

C10H13N3O2 — CID 18935581

IUPAC5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
SMILESO=C(c1cnc[nH]c1=O)N1CCCCC1
InChIInChI=1S/C10H13N3O2/c14-9-8(6-11-7-12-9)10(15)13-4-2-1-3-5-13/h6-7H,1-5H2,(H,11,12,14)
InChIKeyQDSBAZYRBFYIGW-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.40
Rot. Bonds1

About 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one

5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one (PubChem CID 18935581) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
PubChem CID18935581
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
SMILESO=C(c1cnc[nH]c1=O)N1CCCCC1
InChIInChI=1S/C10H13N3O2/c14-9-8(6-11-7-12-9)10(15)13-4-2-1-3-5-13/h6-7H,1-5H2,(H,11,12,14)
InChIKeyQDSBAZYRBFYIGW-UHFFFAOYSA-N
XLogP0.40
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one?
The IUPAC name of 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one (CID 18935581) is 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one?
The canonical SMILES for 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one is O=C(c1cnc[nH]c1=O)N1CCCCC1.
What is the InChIKey of 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one?
The InChIKey is QDSBAZYRBFYIGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c14-9-8(6-11-7-12-9)10(15)13-4-2-1-3-5-13/h6-7H,1-5H2,(H,11,12,14).
What are the key properties of 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one?
5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one has a molecular weight of 207.23 g/mol, XLogP of 0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 18935581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).