N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide

C17H26N4O2 — CID 155875754

IUPACN-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCC(C)C(=O)N1CCC(C(=O)NCC2CC2)(n2cccn2)CC1
InChIInChI=1S/C17H26N4O2/c1-13(2)15(22)20-10-6-17(7-11-20,21-9-3-8-19-21)16(23)18-12-14-4-5-14/h3,8-9,13-14H,4-7,10-12H2,1-2H3,(H,18,23)
InChIKeyWOURPCJFLFNFIM-UHFFFAOYSA-N
MW318.42 g/mol
LogP1.38
Rot. Bonds5

About N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide

N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide (PubChem CID 155875754) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
PubChem CID155875754
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC NameN-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCC(C)C(=O)N1CCC(C(=O)NCC2CC2)(n2cccn2)CC1
InChIInChI=1S/C17H26N4O2/c1-13(2)15(22)20-10-6-17(7-11-20,21-9-3-8-19-21)16(23)18-12-14-4-5-14/h3,8-9,13-14H,4-7,10-12H2,1-2H3,(H,18,23)
InChIKeyWOURPCJFLFNFIM-UHFFFAOYSA-N
XLogP1.38
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(cyclohexanecarbonyl)-N-(cyclopropylmethyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 155875526
N-(cyclopropylmethyl)-1-methylsulfonyl-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 155874326
N-(cyclopropylmethyl)-1-(1-methylpyrazole-3-carbonyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 155874619
N-(cyclopropylmethyl)-4-pyrazol-1-yl-1-(thiophene-3-carbonyl)piperidine-4-carboxamide
CID 155874544
N-(cyclopropylmethyl)-1-[(1-ethylpyrazol-4-yl)methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;formic acid
CID 155879875
N-[(2-methylcyclopropyl)methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120924383
N-[(2,2-dimethylcyclopropyl)methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120932686
N-[2-(dimethylamino)propyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120939947
N-[[2-(cyclopropylmethoxy)phenyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120932903
methyl 2-[(4-pyrazol-1-ylpiperidine-4-carbonyl)amino]acetate;hydrochloride
CID 120924676
N-[[1-(2-methylpropanoyl)piperidin-4-yl]methyl]-6-oxopyran-3-carboxamide
CID 164688722
N-[3-oxo-3-(propan-2-ylamino)propyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120921332

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide (CID 155875754) is N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide is CC(C)C(=O)N1CCC(C(=O)NCC2CC2)(n2cccn2)CC1.
What is the InChIKey of N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The InChIKey is WOURPCJFLFNFIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O2/c1-13(2)15(22)20-10-6-17(7-11-20,21-9-3-8-19-21)16(23)18-12-14-4-5-14/h3,8-9,13-14H,4-7,10-12H2,1-2H3,(H,18,23).
What are the key properties of N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide has a molecular weight of 318.42 g/mol, XLogP of 1.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-(2-methylpropanoyl)-4-pyrazol-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 155875754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).