4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one

C9H14N4O — CID 136873266

IUPAC4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one
SMILESN[C@@H]1CCCN(c2cc(=O)[nH]cn2)C1
InChIInChI=1S/C9H14N4O/c10-7-2-1-3-13(5-7)8-4-9(14)12-6-11-8/h4,6-7H,1-3,5,10H2,(H,11,12,14)/t7-/m1/s1
InChIKeyTZMSSAKOCCFPGJ-SSDOTTSWSA-N
MW194.24 g/mol
LogP-0.30
Rot. Bonds1

About 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one

4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one (PubChem CID 136873266) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one
PubChem CID136873266
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one
SMILESN[C@@H]1CCCN(c2cc(=O)[nH]cn2)C1
InChIInChI=1S/C9H14N4O/c10-7-2-1-3-13(5-7)8-4-9(14)12-6-11-8/h4,6-7H,1-3,5,10H2,(H,11,12,14)/t7-/m1/s1
InChIKeyTZMSSAKOCCFPGJ-SSDOTTSWSA-N
XLogP-0.30
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(Piperidin-1-yl)-3,4-dihydropyrimidin-4-one
CID 136957380
6-(3-Aminopiperidin-1-yl)-3,4-dihydropyrimidin-4-one dihydrochloride
CID 139026488
6-piperazin-1-yl-3H-pyrimidin-4-one
CID 136102540
2-[(3R)-3-aminopiperidin-1-yl]-5-fluoro-1H-pyrimidin-6-one
CID 141182437
2-(3-aminopiperidin-1-yl)-5-fluoro-1H-pyrimidin-6-one
CID 149709905
6-(Cyclohexylamino)pyrimidin-4(1H)-one
CID 136271514
2-amino-6-[4-(5-fluoropentyl)piperazin-1-yl]pyrimidin-4(3H)-one
CID 136663750
4-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]-1H-pyrimidin-6-one
CID 136957809
6-(4,4-Difluoropiperidin-1-yl)pyrimidin-4(3H)-one
CID 146673525
4-[4-(2,2-difluoroethyl)-3-ethylpiperazin-1-yl]-1H-pyrimidin-6-one
CID 154781909
6-(4-Fluoropiperidin-1-yl)-3,4-dihydropyrimidin-4-one
CID 164648869
4-[(1-piperidin-1-ylpropan-2-ylamino)methyl]-1H-pyrimidin-6-one
CID 135906347

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one?
The IUPAC name of 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one (CID 136873266) is 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one?
The canonical SMILES for 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one is N[C@@H]1CCCN(c2cc(=O)[nH]cn2)C1.
What is the InChIKey of 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one?
The InChIKey is TZMSSAKOCCFPGJ-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H14N4O/c10-7-2-1-3-13(5-7)8-4-9(14)12-6-11-8/h4,6-7H,1-3,5,10H2,(H,11,12,14)/t7-/m1/s1.
What are the key properties of 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one?
4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one has a molecular weight of 194.24 g/mol, XLogP of -0.30, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-3-aminopiperidin-1-yl]-1H-pyrimidin-6-one is sourced from PubChem (CID 136873266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).