N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide

C17H22N4O — CID 51224525

IUPACN-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide
SMILESCN(CC(=O)Nc1ccnn1C1CCCC1)c1ccccc1
InChIInChI=1S/C17H22N4O/c1-20(14-7-3-2-4-8-14)13-17(22)19-16-11-12-18-21(16)15-9-5-6-10-15/h2-4,7-8,11-12,15H,5-6,9-10,13H2,1H3,(H,19,22)
InChIKeyBESWAXSCDNLIGN-UHFFFAOYSA-N
MW298.39 g/mol
LogP3.07
Rot. Bonds5

About N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide

N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide (PubChem CID 51224525) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide
PubChem CID51224525
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC NameN-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide
SMILESCN(CC(=O)Nc1ccnn1C1CCCC1)c1ccccc1
InChIInChI=1S/C17H22N4O/c1-20(14-7-3-2-4-8-14)13-17(22)19-16-11-12-18-21(16)15-9-5-6-10-15/h2-4,7-8,11-12,15H,5-6,9-10,13H2,1H3,(H,19,22)
InChIKeyBESWAXSCDNLIGN-UHFFFAOYSA-N
XLogP3.07
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyclopentylpyrazol-3-yl)-2-[N-(2-hydroxyethyl)anilino]acetamide
CID 110881459
N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide
CID 95042358
N-(2-cyclopentylpyrazol-3-yl)-2-[3-hydroxybutyl(methyl)amino]acetamide
CID 111496830
N-(2-cyclopentylpyrazol-3-yl)-2-phenylsulfanylacetamide
CID 31235798
2-(benzotriazol-2-yl)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 134702607
2-[[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 8683009
2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 9438130
2-(benzhydrylamino)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 8596124
(2S)-1-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]pyrrolidine-2-carboxylic acid
CID 119910318
N-(2-cyclopentylpyrazol-3-yl)-2-[methyl(thiophen-3-ylmethyl)amino]acetamide
CID 9437889
N-(2-cyclopentylpyrazol-3-yl)-2-[methyl-[[2-(trifluoromethoxy)phenyl]methyl]amino]acetamide
CID 24665106
N-(2-cyclohexylpyrazol-3-yl)benzamide
CID 51145839

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide?
The IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide (CID 51224525) is N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide.
What is the SMILES notation for N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide?
The canonical SMILES for N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide is CN(CC(=O)Nc1ccnn1C1CCCC1)c1ccccc1.
What is the InChIKey of N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide?
The InChIKey is BESWAXSCDNLIGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O/c1-20(14-7-3-2-4-8-14)13-17(22)19-16-11-12-18-21(16)15-9-5-6-10-15/h2-4,7-8,11-12,15H,5-6,9-10,13H2,1H3,(H,19,22).
What are the key properties of N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide?
N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide has a molecular weight of 298.39 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide is sourced from PubChem (CID 51224525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).