1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide

C15H18N4O — CID 28742838

IUPAC1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide
SMILESO=C(N[C@@H]1CCCNC1)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C15H18N4O/c20-15(18-13-5-4-8-16-10-13)12-9-17-19(11-12)14-6-2-1-3-7-14/h1-3,6-7,9,11,13,16H,4-5,8,10H2,(H,18,20)/t13-/m1/s1
InChIKeyBIZQUVYHLAGELX-CYBMUJFWSA-N
MW270.34 g/mol
LogP1.35
Rot. Bonds3

About 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide

1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide (PubChem CID 28742838) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide
PubChem CID28742838
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide
SMILESO=C(N[C@@H]1CCCNC1)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C15H18N4O/c20-15(18-13-5-4-8-16-10-13)12-9-17-19(11-12)14-6-2-1-3-7-14/h1-3,6-7,9,11,13,16H,4-5,8,10H2,(H,18,20)/t13-/m1/s1
InChIKeyBIZQUVYHLAGELX-CYBMUJFWSA-N
XLogP1.35
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 119424441
1-(4-bromophenyl)-N-pyrrolidin-3-ylpyrazole-4-carboxamide
CID 119453521
(1-phenylpyrazol-4-yl)-piperidin-3-ylmethanone
CID 43140089
N-piperidin-3-ylbenzamide
CID 22017045
1-phenyl-N-piperidin-3-yltriazole-4-carboxamide
CID 119425815
N-(2-methylpiperidin-3-yl)-1-phenylpyrazole-4-carboxamide;hydrochloride
CID 120577775
1-phenyl-N-piperidin-3-ylpyrazole-3-carboxamide;hydrochloride
CID 119429116
5-methyl-1-phenyl-N-piperidin-3-ylpyrazole-4-carboxamide
CID 119427580
1-phenyl-N-(2-pyrrolidin-2-ylethyl)pyrazole-4-carboxamide
CID 114793561
N-(2-bromocyclopentyl)-1-phenylpyrazole-4-carboxamide
CID 80661828
N-[4-(cyclohexylcarbamoyl)-2-methylphenyl]-1-phenylpyrazole-4-carboxamide
CID 55880187
N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-1-phenylpyrazole-4-carboxamide
CID 32526900

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide?
The IUPAC name of 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide (CID 28742838) is 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide.
What is the SMILES notation for 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide?
The canonical SMILES for 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide is O=C(N[C@@H]1CCCNC1)c1cnn(-c2ccccc2)c1.
What is the InChIKey of 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide?
The InChIKey is BIZQUVYHLAGELX-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H18N4O/c20-15(18-13-5-4-8-16-10-13)12-9-17-19(11-12)14-6-2-1-3-7-14/h1-3,6-7,9,11,13,16H,4-5,8,10H2,(H,18,20)/t13-/m1/s1.
What are the key properties of 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide?
1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 1.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 28742838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).