N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide

C10H16N4O — CID 58933866

IUPACN-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide
SMILESO=C(NCC1CCNCC1)c1cn[nH]c1
InChIInChI=1S/C10H16N4O/c15-10(9-6-13-14-7-9)12-5-8-1-3-11-4-2-8/h6-8,11H,1-5H2,(H,12,15)(H,13,14)
InChIKeyUVHHMYCYSMMNFL-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.14
Rot. Bonds3

About N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide

N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide (PubChem CID 58933866) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide
PubChem CID58933866
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC NameN-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide
SMILESO=C(NCC1CCNCC1)c1cn[nH]c1
InChIInChI=1S/C10H16N4O/c15-10(9-6-13-14-7-9)12-5-8-1-3-11-4-2-8/h6-8,11H,1-5H2,(H,12,15)(H,13,14)
InChIKeyUVHHMYCYSMMNFL-UHFFFAOYSA-N
XLogP0.14
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 ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide (CID 58933866) is N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide is O=C(NCC1CCNCC1)c1cn[nH]c1.
What is the InChIKey of N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide?
The InChIKey is UVHHMYCYSMMNFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c15-10(9-6-13-14-7-9)12-5-8-1-3-11-4-2-8/h6-8,11H,1-5H2,(H,12,15)(H,13,14).
What are the key properties of N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide?
N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 0.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 58933866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).