5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide

C15H26N4O — CID 56716648

IUPAC5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)NCCC2CCCN(C)C2)c1C
InChIInChI=1S/C15H26N4O/c1-4-13-11(2)14(18-17-13)15(20)16-8-7-12-6-5-9-19(3)10-12/h12H,4-10H2,1-3H3,(H,16,20)(H,17,18)
InChIKeyBZYKQMIIMPLXRC-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.74
Rot. Bonds5

About 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide

5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide (PubChem CID 56716648) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide
PubChem CID56716648
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)NCCC2CCCN(C)C2)c1C
InChIInChI=1S/C15H26N4O/c1-4-13-11(2)14(18-17-13)15(20)16-8-7-12-6-5-9-19(3)10-12/h12H,4-10H2,1-3H3,(H,16,20)(H,17,18)
InChIKeyBZYKQMIIMPLXRC-UHFFFAOYSA-N
XLogP1.74
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide (CID 56716648) is 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)NCCC2CCCN(C)C2)c1C.
What is the InChIKey of 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide?
The InChIKey is BZYKQMIIMPLXRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-13-11(2)14(18-17-13)15(20)16-8-7-12-6-5-9-19(3)10-12/h12H,4-10H2,1-3H3,(H,16,20)(H,17,18).
What are the key properties of 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide?
5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 56716648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).