(3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide

C14H24N4O — CID 81124224

IUPAC(3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide
SMILESCc1nn(C(C)C)c(C)c1NC(=O)[C@@H]1CCCNC1
InChIInChI=1S/C14H24N4O/c1-9(2)18-11(4)13(10(3)17-18)16-14(19)12-6-5-7-15-8-12/h9,12,15H,5-8H2,1-4H3,(H,16,19)/t12-/m1/s1
InChIKeyCMMZVPFZJHSOJH-GFCCVEGCSA-N
MW264.37 g/mol
LogP2.02
Rot. Bonds3

About (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide

(3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide (PubChem CID 81124224) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide
PubChem CID81124224
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name(3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide
SMILESCc1nn(C(C)C)c(C)c1NC(=O)[C@@H]1CCCNC1
InChIInChI=1S/C14H24N4O/c1-9(2)18-11(4)13(10(3)17-18)16-14(19)12-6-5-7-15-8-12/h9,12,15H,5-8H2,1-4H3,(H,16,19)/t12-/m1/s1
InChIKeyCMMZVPFZJHSOJH-GFCCVEGCSA-N
XLogP2.02
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)cyclopropanecarboxamide
CID 61215930
N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-piperidin-3-ylacetamide
CID 62676677
N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-3-methylpyrrolidine-2-carboxamide
CID 102778414
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperidine-3-carboxamide
CID 119275721
(3R)-N-(1,3-dimethylpyrazol-4-yl)piperidine-3-carboxamide
CID 102805576
N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119299043
(3S)-N-(1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide
CID 81139176
N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119263416
(3S)-N-(4-bromo-2,6-dimethylphenyl)piperidine-3-carboxamide
CID 28562759
(3R)-N-(2,6-dimethyl-3-pyridinyl)piperidine-3-carboxamide
CID 81133991
2-(cyclopropylamino)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)acetamide
CID 54863665
(3R)-N-(4,6-dichloropyrimidin-5-yl)piperidine-3-carboxamide
CID 114074295

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide (CID 81124224) is (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide is Cc1nn(C(C)C)c(C)c1NC(=O)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide?
The InChIKey is CMMZVPFZJHSOJH-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H24N4O/c1-9(2)18-11(4)13(10(3)17-18)16-14(19)12-6-5-7-15-8-12/h9,12,15H,5-8H2,1-4H3,(H,16,19)/t12-/m1/s1.
What are the key properties of (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide?
(3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 81124224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).