N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide

C20H26N4O — CID 95042358

IUPACN-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide
SMILESCN(CC(=O)Nc1ccnn1C1CCCC1)[C@H]1CCc2ccccc21
InChIInChI=1S/C20H26N4O/c1-23(18-11-10-15-6-2-5-9-17(15)18)14-20(25)22-19-12-13-21-24(19)16-7-3-4-8-16/h2,5-6,9,12-13,16,18H,3-4,7-8,10-11,14H2,1H3,(H,22,25)/t18-/m0/s1
InChIKeyDWAZYBOAAFGMJH-SFHVURJKSA-N
MW338.45 g/mol
LogP3.56
Rot. Bonds5

About N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide

N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide (PubChem CID 95042358) has the molecular formula C20H26N4O and a molecular weight of 338.45 g/mol. Its IUPAC name is N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide
PubChem CID95042358
Molecular FormulaC20H26N4O
Molecular Weight338.45 g/mol
Exact Mass338.21
IUPAC NameN-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide
SMILESCN(CC(=O)Nc1ccnn1C1CCCC1)[C@H]1CCc2ccccc21
InChIInChI=1S/C20H26N4O/c1-23(18-11-10-15-6-2-5-9-17(15)18)14-20(25)22-19-12-13-21-24(19)16-7-3-4-8-16/h2,5-6,9,12-13,16,18H,3-4,7-8,10-11,14H2,1H3,(H,22,25)/t18-/m0/s1
InChIKeyDWAZYBOAAFGMJH-SFHVURJKSA-N
XLogP3.56
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyclohexylpyrazol-3-yl)-2-(2,3-dihydro-1H-inden-1-yl)acetamide
CID 86955324
N-(2-cyclopentylpyrazol-3-yl)-2-(N-methylanilino)acetamide
CID 51224525
N-(2-cyclopentylpyrazol-3-yl)-2-[3-hydroxybutyl(methyl)amino]acetamide
CID 111496830
2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-N-(4-methylphenyl)acetamide
CID 36674283
2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]-N-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 36674496
N-(2-cyclopentylpyrazol-3-yl)-2-[N-(2-hydroxyethyl)anilino]acetamide
CID 110881459
2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]-N-ethylacetamide
CID 134043159
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-(2,3-dihydro-1H-inden-5-yl)-2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide
CID 36676150
2-[[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 8683009
2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-N-naphthalen-1-ylacetamide
CID 36674335

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide?
The IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide (CID 95042358) is N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide.
What is the SMILES notation for N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide?
The canonical SMILES for N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide is CN(CC(=O)Nc1ccnn1C1CCCC1)[C@H]1CCc2ccccc21.
What is the InChIKey of N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide?
The InChIKey is DWAZYBOAAFGMJH-SFHVURJKSA-N. The full InChI is InChI=1S/C20H26N4O/c1-23(18-11-10-15-6-2-5-9-17(15)18)14-20(25)22-19-12-13-21-24(19)16-7-3-4-8-16/h2,5-6,9,12-13,16,18H,3-4,7-8,10-11,14H2,1H3,(H,22,25)/t18-/m0/s1.
What are the key properties of N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide?
N-(2-cyclopentylpyrazol-3-yl)-2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide has a molecular weight of 338.45 g/mol, XLogP of 3.56, 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-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide is sourced from PubChem (CID 95042358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).