4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide

C12H20N4O — CID 63122589

IUPAC4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide
SMILESCc1[nH]ncc1CNC(=O)C1(C)CCNCC1
InChIInChI=1S/C12H20N4O/c1-9-10(8-15-16-9)7-14-11(17)12(2)3-5-13-6-4-12/h8,13H,3-7H2,1-2H3,(H,14,17)(H,15,16)
InChIKeyZLXWSYHZSNDVDR-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.72
Rot. Bonds3

About 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide

4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide (PubChem CID 63122589) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide
PubChem CID63122589
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide
SMILESCc1[nH]ncc1CNC(=O)C1(C)CCNCC1
InChIInChI=1S/C12H20N4O/c1-9-10(8-15-16-9)7-14-11(17)12(2)3-5-13-6-4-12/h8,13H,3-7H2,1-2H3,(H,14,17)(H,15,16)
InChIKeyZLXWSYHZSNDVDR-UHFFFAOYSA-N
XLogP0.72
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide?
The IUPAC name of 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide (CID 63122589) is 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide is Cc1[nH]ncc1CNC(=O)C1(C)CCNCC1.
What is the InChIKey of 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide?
The InChIKey is ZLXWSYHZSNDVDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9-10(8-15-16-9)7-14-11(17)12(2)3-5-13-6-4-12/h8,13H,3-7H2,1-2H3,(H,14,17)(H,15,16).
What are the key properties of 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide?
4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 0.72, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 63122589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).