N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride

C13H23ClN4O — CID 119295241

IUPACN-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride
SMILESCC(CNC(=O)C1CCCNC1)Cn1cccn1.Cl
InChIInChI=1S/C13H22N4O.ClH/c1-11(10-17-7-3-6-16-17)8-15-13(18)12-4-2-5-14-9-12;/h3,6-7,11-12,14H,2,4-5,8-10H2,1H3,(H,15,18);1H
InChIKeyFXGNXBFBEKAHTJ-UHFFFAOYSA-N
MW286.81 g/mol
LogP1.06
Rot. Bonds5

About N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride

N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119295241) has the molecular formula C13H23ClN4O and a molecular weight of 286.81 g/mol. Its IUPAC name is N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride
PubChem CID119295241
Molecular FormulaC13H23ClN4O
Molecular Weight286.81 g/mol
Exact Mass286.16
IUPAC NameN-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride
SMILESCC(CNC(=O)C1CCCNC1)Cn1cccn1.Cl
InChIInChI=1S/C13H22N4O.ClH/c1-11(10-17-7-3-6-16-17)8-15-13(18)12-4-2-5-14-9-12;/h3,6-7,11-12,14H,2,4-5,8-10H2,1H3,(H,15,18);1H
InChIKeyFXGNXBFBEKAHTJ-UHFFFAOYSA-N
XLogP1.06
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.81
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(2-methyl-3-pyrazol-1-ylpropyl)cyclohexane-1-carboxamide;hydrochloride
CID 119734117
N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide
CID 119734124
3-amino-N-(2-methyl-3-pyrazol-1-ylpropyl)cyclopentane-1-carboxamide;hydrochloride
CID 119734111
N-(2-methyl-3-pyrazol-1-ylpropyl)-4-piperidin-3-ylbenzamide
CID 167866370
(3R)-1-[(2S)-2-methylbutanoyl]-N-[(2S)-2-methyl-3-pyrazol-1-ylpropyl]piperidine-3-carboxamide
CID 98756044
N-(2-methyl-3-morpholin-4-ylpropyl)piperidine-3-carboxamide
CID 110462388
N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride
CID 119330823
N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrrolidine-3-carboxamide
CID 63005234
(3R)-N-(3-methoxy-2-methylpropyl)piperidine-3-carboxamide
CID 81140932
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
N-[3-(4-ethylpiperazin-1-yl)-2-methylpropyl]pyrrolidine-3-carboxamide;trihydrochloride
CID 119902553
N-(1-imidazol-1-ylpropan-2-yl)piperidine-3-carboxamide
CID 43695432

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride (CID 119295241) is N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride is CC(CNC(=O)C1CCCNC1)Cn1cccn1.Cl.
What is the InChIKey of N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is FXGNXBFBEKAHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O.ClH/c1-11(10-17-7-3-6-16-17)8-15-13(18)12-4-2-5-14-9-12;/h3,6-7,11-12,14H,2,4-5,8-10H2,1H3,(H,15,18);1H.
What are the key properties of N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride?
N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 286.81 g/mol, XLogP of 1.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119295241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).