N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide

C20H27N3O2 — CID 112819311

IUPACN-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide
SMILESCC(C)OCCC(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1
InChIInChI=1S/C20H27N3O2/c1-15(2)25-13-12-20(24)21-19-14-18(16-8-6-7-9-16)22-23(19)17-10-4-3-5-11-17/h3-5,10-11,14-16H,6-9,12-13H2,1-2H3,(H,21,24)
InChIKeyAZKCNFIBLVGQBC-UHFFFAOYSA-N
MW341.46 g/mol
LogP4.28
Rot. Bonds7

About N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide

N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide (PubChem CID 112819311) has the molecular formula C20H27N3O2 and a molecular weight of 341.46 g/mol. Its IUPAC name is N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide.

Molecular Properties

Compound NameN-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide
PubChem CID112819311
Molecular FormulaC20H27N3O2
Molecular Weight341.46 g/mol
Exact Mass341.21
IUPAC NameN-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide
SMILESCC(C)OCCC(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1
InChIInChI=1S/C20H27N3O2/c1-15(2)25-13-12-20(24)21-19-14-18(16-8-6-7-9-16)22-23(19)17-10-4-3-5-11-17/h3-5,10-11,14-16H,6-9,12-13H2,1-2H3,(H,21,24)
InChIKeyAZKCNFIBLVGQBC-UHFFFAOYSA-N
XLogP4.28
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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3-acetamido-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-phenylpropanamide
CID 78830466
2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide
CID 119684822
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CID 2778369
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-2-[4-[(S)-hydroxy(phenyl)methyl]piperidin-1-yl]acetamide
CID 36672610
phenyl N-(3-cyclobutyl-1-phenylpyrazol-5-yl)carbamate
CID 66876742
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide;hydrochloride
CID 119684833
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CID 78830462
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CID 56520964
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-1-ethylsulfonylpiperidine-4-carboxamide
CID 78830494
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide?
The IUPAC name of N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide (CID 112819311) is N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide.
What is the SMILES notation for N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide?
The canonical SMILES for N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide is CC(C)OCCC(=O)Nc1cc(C2CCCC2)nn1-c1ccccc1.
What is the InChIKey of N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide?
The InChIKey is AZKCNFIBLVGQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-15(2)25-13-12-20(24)21-19-14-18(16-8-6-7-9-16)22-23(19)17-10-4-3-5-11-17/h3-5,10-11,14-16H,6-9,12-13H2,1-2H3,(H,21,24).
What are the key properties of N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide?
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide has a molecular weight of 341.46 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide is sourced from PubChem (CID 112819311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).