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

C16H17N3O2 — CID 92648674

IUPAC2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
SMILESO=C(c1cnc(-c2ccccc2)[nH]c1=O)N1CCCCC1
InChIInChI=1S/C16H17N3O2/c20-15-13(16(21)19-9-5-2-6-10-19)11-17-14(18-15)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,17,18,20)
InChIKeyLNPZLSKYIHIGKI-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.06
Rot. Bonds2

About 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one

2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one (PubChem CID 92648674) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
PubChem CID92648674
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
SMILESO=C(c1cnc(-c2ccccc2)[nH]c1=O)N1CCCCC1
InChIInChI=1S/C16H17N3O2/c20-15-13(16(21)19-9-5-2-6-10-19)11-17-14(18-15)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,17,18,20)
InChIKeyLNPZLSKYIHIGKI-UHFFFAOYSA-N
XLogP2.06
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-phenyl-5-(piperidine-1-carbonyl)-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

5-(4-methylpiperazine-1-carbonyl)-2-phenyl-1H-pyrimidin-6-one
CID 92648681
5-(4-benzylpiperazine-1-carbonyl)-2-phenyl-1H-pyrimidin-6-one
CID 92648682
ethyl 4-(6-oxo-2-phenyl-1H-pyrimidine-5-carbonyl)piperazine-1-carboxylate
CID 92648692
5-(4-phenyl-3,6-dihydro-2H-pyridine-1-carbonyl)-2-pyridin-3-yl-1H-pyrimidin-6-one
CID 72908260
5-(2-azaspiro[4.4]nonane-2-carbonyl)-2-(4-methylphenyl)-1H-pyrimidin-6-one
CID 70768057
6-oxo-2-phenyl-N-(4-pyrrolidin-1-ylbutyl)-1H-pyrimidine-5-carboxamide
CID 70724558
2-[(2,6-dichlorophenyl)methyl]-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
CID 70734474
2-(4-methylphenyl)-5-[3-[(2S)-2-methylpiperidin-1-yl]azetidine-1-carbonyl]-1H-pyrimidin-6-one
CID 97141903
(2-phenylpyrimidin-5-yl)-piperidin-1-ylmethanone
CID 2229074
3-phenyl-6-(piperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 3469841
5-[4-[(1R,2R)-2-hydroxycyclohexyl]piperazine-1-carbonyl]-2-pyridin-2-yl-1H-pyrimidin-6-one
CID 133121935
2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(pyrrolidine-1-carbonyl)-1H-pyrimidin-6-one
CID 42682738

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one?
The IUPAC name of 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one (CID 92648674) is 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one?
The canonical SMILES for 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one is O=C(c1cnc(-c2ccccc2)[nH]c1=O)N1CCCCC1.
What is the InChIKey of 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one?
The InChIKey is LNPZLSKYIHIGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c20-15-13(16(21)19-9-5-2-6-10-19)11-17-14(18-15)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,17,18,20).
What are the key properties of 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one?
2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one has a molecular weight of 283.33 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 92648674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).