N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide

C14H23N3O2 — CID 154832328

IUPACN-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide
SMILESCC(C)Cn1[nH]c(CC(=O)NC2CCCC2)cc1=O
InChIInChI=1S/C14H23N3O2/c1-10(2)9-17-14(19)8-12(16-17)7-13(18)15-11-5-3-4-6-11/h8,10-11,16H,3-7,9H2,1-2H3,(H,15,18)
InChIKeyWWBSKQBDRVTBEA-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.43
Rot. Bonds5

About N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide

N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide (PubChem CID 154832328) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide
PubChem CID154832328
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide
SMILESCC(C)Cn1[nH]c(CC(=O)NC2CCCC2)cc1=O
InChIInChI=1S/C14H23N3O2/c1-10(2)9-17-14(19)8-12(16-17)7-13(18)15-11-5-3-4-6-11/h8,10-11,16H,3-7,9H2,1-2H3,(H,15,18)
InChIKeyWWBSKQBDRVTBEA-UHFFFAOYSA-N
XLogP1.43
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide (CID 154832328) is N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide is CC(C)Cn1[nH]c(CC(=O)NC2CCCC2)cc1=O.
What is the InChIKey of N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide?
The InChIKey is WWBSKQBDRVTBEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10(2)9-17-14(19)8-12(16-17)7-13(18)15-11-5-3-4-6-11/h8,10-11,16H,3-7,9H2,1-2H3,(H,15,18).
What are the key properties of N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide?
N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide has a molecular weight of 265.36 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[2-(2-methylpropyl)-3-oxo-1H-pyrazol-5-yl]acetamide is sourced from PubChem (CID 154832328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).