(3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide

C16H18N4O — CID 51443831

IUPAC(3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide
SMILESO=C(Nc1ccccc1)[C@@H]1CCCN(c2ncccn2)C1
InChIInChI=1S/C16H18N4O/c21-15(19-14-7-2-1-3-8-14)13-6-4-11-20(12-13)16-17-9-5-10-18-16/h1-3,5,7-10,13H,4,6,11-12H2,(H,19,21)/t13-/m1/s1
InChIKeyTZFCCWZEDLORGR-CYBMUJFWSA-N
MW282.35 g/mol
LogP2.33
Rot. Bonds3

About (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide

(3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide (PubChem CID 51443831) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide
PubChem CID51443831
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name(3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide
SMILESO=C(Nc1ccccc1)[C@@H]1CCCN(c2ncccn2)C1
InChIInChI=1S/C16H18N4O/c21-15(19-14-7-2-1-3-8-14)13-6-4-11-20(12-13)16-17-9-5-10-18-16/h1-3,5,7-10,13H,4,6,11-12H2,(H,19,21)/t13-/m1/s1
InChIKeyTZFCCWZEDLORGR-CYBMUJFWSA-N
XLogP2.33
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide 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

(3R)-N-(3-fluorophenyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 51686412
N-(2-piperidin-1-ylphenyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 55557554
(3S)-N-[4-[(2R)-butan-2-yl]phenyl]-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 7206249
(3R)-1-[5-(3-fluorophenyl)pyrimidin-2-yl]-N-phenylpiperidine-3-carboxamide
CID 95085728
(3R)-N-(6-methoxy-3-pyridinyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 34970341
N-(4-methylphenyl)-1-(5-phenylpyrimidin-2-yl)piperidine-3-carboxamide
CID 53107179
N-(3-bromo-4-methylphenyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 134053965
(3S)-N-(benzenesulfonyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 94185832
(3S)-N-(3-methyl-2-pyridinyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 25352704
1-pyrimidin-2-ylpiperidine-3-carboxylic acid;hydrochloride
CID 45075103
(3R)-1-pyrimidin-2-yl-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 40599471
(3R)-N-cyclopropyl-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 6557829

Frequently Asked Questions

What is the IUPAC name of (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide?
The IUPAC name of (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide (CID 51443831) is (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide?
The canonical SMILES for (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide is O=C(Nc1ccccc1)[C@@H]1CCCN(c2ncccn2)C1.
What is the InChIKey of (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide?
The InChIKey is TZFCCWZEDLORGR-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H18N4O/c21-15(19-14-7-2-1-3-8-14)13-6-4-11-20(12-13)16-17-9-5-10-18-16/h1-3,5,7-10,13H,4,6,11-12H2,(H,19,21)/t13-/m1/s1.
What are the key properties of (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide?
(3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide has a molecular weight of 282.35 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-phenyl-1-pyrimidin-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 51443831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).