N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide

C14H24N4O — CID 120922205

IUPACN-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCC(C)(C)CNC(=O)C1(n2cccn2)CCNCC1
InChIInChI=1S/C14H24N4O/c1-13(2,3)11-16-12(19)14(5-8-15-9-6-14)18-10-4-7-17-18/h4,7,10,15H,5-6,8-9,11H2,1-3H3,(H,16,19)
InChIKeyVGJKLRYBGQALDM-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.12
Rot. Bonds3

About N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide

N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide (PubChem CID 120922205) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
PubChem CID120922205
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCC(C)(C)CNC(=O)C1(n2cccn2)CCNCC1
InChIInChI=1S/C14H24N4O/c1-13(2,3)11-16-12(19)14(5-8-15-9-6-14)18-10-4-7-17-18/h4,7,10,15H,5-6,8-9,11H2,1-3H3,(H,16,19)
InChIKeyVGJKLRYBGQALDM-UHFFFAOYSA-N
XLogP1.12
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 ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxy-2-methylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120933453
4-pyrazol-1-yl-N-(2,2,2-trifluoroethyl)piperidine-4-carboxamide;hydrochloride
CID 120924691
N-[2-(tert-butylamino)-2-oxoethyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120919791
methyl 2-[(4-pyrazol-1-ylpiperidine-4-carbonyl)amino]acetate;hydrochloride
CID 120924676
N-[2-(4-chlorophenyl)-2-methylpropyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120926251
N-[2-(2,6-dichlorophenyl)-2-methylpropyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120931395
N-(2-ethyl-2-phenylbutyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120935683
N-[(1-ethylcyclopropyl)methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120932245
N-[(2,2-dimethylcyclopropyl)methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120932686
N-[2-methyl-2-[3-(trifluoromethyl)phenyl]propyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120930774
N-[2-(dimethylamino)propyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120939947
N-[(2-methylcyclopropyl)methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120924383

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The IUPAC name of N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide (CID 120922205) is N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide is CC(C)(C)CNC(=O)C1(n2cccn2)CCNCC1.
What is the InChIKey of N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The InChIKey is VGJKLRYBGQALDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-13(2,3)11-16-12(19)14(5-8-15-9-6-14)18-10-4-7-17-18/h4,7,10,15H,5-6,8-9,11H2,1-3H3,(H,16,19).
What are the key properties of N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-4-pyrazol-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 120922205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).