N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide

C11H16N4O2 — CID 874546

IUPACN-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide
SMILESCNC(=O)n1ccc(C(=O)N2CCCCC2)n1
InChIInChI=1S/C11H16N4O2/c1-12-11(17)15-8-5-9(13-15)10(16)14-6-3-2-4-7-14/h5,8H,2-4,6-7H2,1H3,(H,12,17)
InChIKeyFWLYFZYJMIKTBH-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.70
Rot. Bonds1

About N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide

N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide (PubChem CID 874546) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide.

Molecular Properties

Compound NameN-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide
PubChem CID874546
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC NameN-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide
SMILESCNC(=O)n1ccc(C(=O)N2CCCCC2)n1
InChIInChI=1S/C11H16N4O2/c1-12-11(17)15-8-5-9(13-15)10(16)14-6-3-2-4-7-14/h5,8H,2-4,6-7H2,1H3,(H,12,17)
InChIKeyFWLYFZYJMIKTBH-UHFFFAOYSA-N
XLogP0.70
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 110201708
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CID 25855597
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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide?
The IUPAC name of N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide (CID 874546) is N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide.
What is the SMILES notation for N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide?
The canonical SMILES for N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide is CNC(=O)n1ccc(C(=O)N2CCCCC2)n1.
What is the InChIKey of N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide?
The InChIKey is FWLYFZYJMIKTBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-12-11(17)15-8-5-9(13-15)10(16)14-6-3-2-4-7-14/h5,8H,2-4,6-7H2,1H3,(H,12,17).
What are the key properties of N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide?
N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(piperidine-1-carbonyl)pyrazole-1-carboxamide is sourced from PubChem (CID 874546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).