4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide

C14H22N4O2 — CID 71972608

IUPAC4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide
SMILESCC(C)CC(C(=O)Nc1cn[nH]c1)N1CCCCC1=O
InChIInChI=1S/C14H22N4O2/c1-10(2)7-12(18-6-4-3-5-13(18)19)14(20)17-11-8-15-16-9-11/h8-10,12H,3-7H2,1-2H3,(H,15,16)(H,17,20)
InChIKeyWVAVPTIBTFYFFU-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.78
Rot. Bonds5

About 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide

4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide (PubChem CID 71972608) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide.

Molecular Properties

Compound Name4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide
PubChem CID71972608
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide
SMILESCC(C)CC(C(=O)Nc1cn[nH]c1)N1CCCCC1=O
InChIInChI=1S/C14H22N4O2/c1-10(2)7-12(18-6-4-3-5-13(18)19)14(20)17-11-8-15-16-9-11/h8-10,12H,3-7H2,1-2H3,(H,15,16)(H,17,20)
InChIKeyWVAVPTIBTFYFFU-UHFFFAOYSA-N
XLogP1.78
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide?
The IUPAC name of 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide (CID 71972608) is 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide.
What is the SMILES notation for 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide?
The canonical SMILES for 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide is CC(C)CC(C(=O)Nc1cn[nH]c1)N1CCCCC1=O.
What is the InChIKey of 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide?
The InChIKey is WVAVPTIBTFYFFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-10(2)7-12(18-6-4-3-5-13(18)19)14(20)17-11-8-15-16-9-11/h8-10,12H,3-7H2,1-2H3,(H,15,16)(H,17,20).
What are the key properties of 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide?
4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide has a molecular weight of 278.36 g/mol, XLogP of 1.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2-oxopiperidin-1-yl)-N-(1H-pyrazol-4-yl)pentanamide is sourced from PubChem (CID 71972608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).