N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide

C21H24N4OS — CID 17462248

IUPACN-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide
SMILESO=C(CNC(c1ccccc1)c1cccs1)Nc1ccnn1C1CCCC1
InChIInChI=1S/C21H24N4OS/c26-20(24-19-12-13-23-25(19)17-9-4-5-10-17)15-22-21(18-11-6-14-27-18)16-7-2-1-3-8-16/h1-3,6-8,11-14,17,21-22H,4-5,9-10,15H2,(H,24,26)
InChIKeyVGBICOQAWBPTAC-UHFFFAOYSA-N
MW380.52 g/mol
LogP4.38
Rot. Bonds7

About N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide

N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide (PubChem CID 17462248) has the molecular formula C21H24N4OS and a molecular weight of 380.52 g/mol. Its IUPAC name is N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide
PubChem CID17462248
Molecular FormulaC21H24N4OS
Molecular Weight380.52 g/mol
Exact Mass380.17
IUPAC NameN-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide
SMILESO=C(CNC(c1ccccc1)c1cccs1)Nc1ccnn1C1CCCC1
InChIInChI=1S/C21H24N4OS/c26-20(24-19-12-13-23-25(19)17-9-4-5-10-17)15-22-21(18-11-6-14-27-18)16-7-2-1-3-8-16/h1-3,6-8,11-14,17,21-22H,4-5,9-10,15H2,(H,24,26)
InChIKeyVGBICOQAWBPTAC-UHFFFAOYSA-N
XLogP4.38
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.52
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(benzhydrylamino)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 8596124
N-(2-cyclopentylpyrazol-3-yl)-2-[[(S)-furan-2-yl(phenyl)methyl]amino]acetamide
CID 8755834
N-[(S)-phenyl(thiophen-2-yl)methyl]-2-[[(S)-phenyl(thiophen-2-yl)methyl]amino]acetamide
CID 8866543
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-[(R)-(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]azanium
CID 8998211
N-(2-cyclopentylpyrazol-3-yl)-2-phenylsulfanylacetamide
CID 31235798
N-(2-cyclopentylpyrazol-3-yl)-2-[[(1R)-1-(furan-2-yl)ethyl]amino]acetamide
CID 8920834
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-[(S)-(4-methylphenyl)-phenylmethyl]azanium
CID 8640348
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-[(S)-furan-2-yl(phenyl)methyl]azanium
CID 8755833
N-cyclopropyl-2-[[2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]acetyl]amino]benzamide
CID 41103017
N-(2-cyclohexylpyrazol-3-yl)-2-(4-methyl-3-thiophen-2-ylpyrazol-1-yl)acetamide
CID 46994696
N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide
CID 51224525
2-(benzotriazol-2-yl)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 134702607

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide?
The IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide (CID 17462248) is N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide.
What is the SMILES notation for N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide?
The canonical SMILES for N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide is O=C(CNC(c1ccccc1)c1cccs1)Nc1ccnn1C1CCCC1.
What is the InChIKey of N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide?
The InChIKey is VGBICOQAWBPTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4OS/c26-20(24-19-12-13-23-25(19)17-9-4-5-10-17)15-22-21(18-11-6-14-27-18)16-7-2-1-3-8-16/h1-3,6-8,11-14,17,21-22H,4-5,9-10,15H2,(H,24,26).
What are the key properties of N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide?
N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide has a molecular weight of 380.52 g/mol, XLogP of 4.38, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylpyrazol-3-yl)-2-[[phenyl(thiophen-2-yl)methyl]amino]acetamide is sourced from PubChem (CID 17462248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).