N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide

C10H16N4O — CID 61000515

IUPACN-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide
SMILESO=C(NCc1cn[nH]c1)C1CCCNC1
InChIInChI=1S/C10H16N4O/c15-10(9-2-1-3-11-7-9)12-4-8-5-13-14-6-8/h5-6,9,11H,1-4,7H2,(H,12,15)(H,13,14)
InChIKeyVDLVQJPTWOCMCN-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.03
Rot. Bonds3

About N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide

N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide (PubChem CID 61000515) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide
PubChem CID61000515
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC NameN-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide
SMILESO=C(NCc1cn[nH]c1)C1CCCNC1
InChIInChI=1S/C10H16N4O/c15-10(9-2-1-3-11-7-9)12-4-8-5-13-14-6-8/h5-6,9,11H,1-4,7H2,(H,12,15)(H,13,14)
InChIKeyVDLVQJPTWOCMCN-UHFFFAOYSA-N
XLogP0.03
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-pyrazol-4-ylmethyl)piperidine-4-carboxamide
CID 61000741
N-(pyridin-4-ylmethyl)piperidine-3-carboxamide;hydrochloride
CID 56832251
(3S)-N-[(6-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide
CID 81140194
N-[(4-methylphenyl)methyl]piperidine-3-carboxamide
CID 18073073
(3S)-N-[(4-ethylphenyl)methyl]piperidine-3-carboxamide
CID 94688914
methyl 4-[[[(3R)-piperidine-3-carbonyl]amino]methyl]benzoate
CID 81139605
(3R)-N-[(4-cyanophenyl)methyl]piperidine-3-carboxamide
CID 81124360
(3R)-N-[[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide
CID 81141127
N-[(3-hydroxyphenyl)methyl]piperidine-3-carboxamide
CID 110471905
(3R)-N-[(4-propan-2-ylphenyl)methyl]piperidine-3-carboxamide
CID 81139149
(3S)-N-[[4-(trifluoromethoxy)phenyl]methyl]piperidine-3-carboxamide
CID 81133538
N-[(4-cyclohexyloxyphenyl)methyl]piperidine-3-carboxamide
CID 119312808

Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide (CID 61000515) is N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide is O=C(NCc1cn[nH]c1)C1CCCNC1.
What is the InChIKey of N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide?
The InChIKey is VDLVQJPTWOCMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c15-10(9-2-1-3-11-7-9)12-4-8-5-13-14-6-8/h5-6,9,11H,1-4,7H2,(H,12,15)(H,13,14).
What are the key properties of N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide?
N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 0.03, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrazol-4-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 61000515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).