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

C11H18N4O — CID 104619119

IUPAC4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide
SMILESCc1cn[nH]c1NC(=O)C1(C)CCNCC1
InChIInChI=1S/C11H18N4O/c1-8-7-13-15-9(8)14-10(16)11(2)3-5-12-6-4-11/h7,12H,3-6H2,1-2H3,(H2,13,14,15,16)
InChIKeyWFNQFMMBCICBEH-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.05
Rot. Bonds2

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

4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide (PubChem CID 104619119) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide
PubChem CID104619119
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide
SMILESCc1cn[nH]c1NC(=O)C1(C)CCNCC1
InChIInChI=1S/C11H18N4O/c1-8-7-13-15-9(8)14-10(16)11(2)3-5-12-6-4-11/h7,12H,3-6H2,1-2H3,(H2,13,14,15,16)
InChIKeyWFNQFMMBCICBEH-UHFFFAOYSA-N
XLogP1.05
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide?
The IUPAC name of 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide (CID 104619119) is 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide?
The canonical SMILES for 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide is Cc1cn[nH]c1NC(=O)C1(C)CCNCC1.
What is the InChIKey of 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide?
The InChIKey is WFNQFMMBCICBEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8-7-13-15-9(8)14-10(16)11(2)3-5-12-6-4-11/h7,12H,3-6H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide?
4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.05, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-methyl-1H-pyrazol-5-yl)piperidine-4-carboxamide is sourced from PubChem (CID 104619119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).