N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide

C17H21N3O2 — CID 100819839

IUPACN-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide
SMILESCc1cn(-c2ccccc2)nc1OCC(=O)NC1CCCC1
InChIInChI=1S/C17H21N3O2/c1-13-11-20(15-9-3-2-4-10-15)19-17(13)22-12-16(21)18-14-7-5-6-8-14/h2-4,9-11,14H,5-8,12H2,1H3,(H,18,21)
InChIKeySJSKVTIGPGLILW-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.62
Rot. Bonds5

About N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide

N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide (PubChem CID 100819839) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide
PubChem CID100819839
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC NameN-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide
SMILESCc1cn(-c2ccccc2)nc1OCC(=O)NC1CCCC1
InChIInChI=1S/C17H21N3O2/c1-13-11-20(15-9-3-2-4-10-15)19-17(13)22-12-16(21)18-14-7-5-6-8-14/h2-4,9-11,14H,5-8,12H2,1H3,(H,18,21)
InChIKeySJSKVTIGPGLILW-UHFFFAOYSA-N
XLogP2.62
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chloro-1-phenylpyrazol-3-yl)oxy-N-cyclopentylacetamide
CID 100829183
ethyl 4-[2-(cyclooctylamino)-2-oxoethoxy]-1-phenylpyrazole-3-carboxylate
CID 55750602
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-1-piperidin-1-ylethanone
CID 100819889
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-1-[(3S)-3-methylpiperidin-1-yl]ethanone
CID 100819878
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
CID 100819848
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide
CID 126421596
3-[[2-(4-bromo-1-phenylpyrazol-3-yl)oxyacetyl]amino]-N-cyclopropylpropanamide
CID 100829150
(2S)-2-(4-chloro-1-phenylpyrazol-3-yl)oxy-N-cyclopentylpropanamide
CID 100829263
[2-(cycloheptylamino)-2-oxoethyl] 3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enoate
CID 5085463
2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide
CID 110735883
N-cycloheptyl-2-[3-(tetrazol-1-yl)phenoxy]acetamide
CID 26215976
[2-(cyclopentylamino)-2-oxoethyl] 3-(3-methoxyphenyl)-1-phenylpyrazole-4-carboxylate
CID 2357802

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide?
The IUPAC name of N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide (CID 100819839) is N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide.
What is the SMILES notation for N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide?
The canonical SMILES for N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide is Cc1cn(-c2ccccc2)nc1OCC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide?
The InChIKey is SJSKVTIGPGLILW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-13-11-20(15-9-3-2-4-10-15)19-17(13)22-12-16(21)18-14-7-5-6-8-14/h2-4,9-11,14H,5-8,12H2,1H3,(H,18,21).
What are the key properties of N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide?
N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide has a molecular weight of 299.37 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide is sourced from PubChem (CID 100819839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).