N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide

C18H22N4O2 — CID 26542850

IUPACN-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
SMILESN#CC1(NC(=O)CNc2ccccc2N2CCCC2=O)CCCC1
InChIInChI=1S/C18H22N4O2/c19-13-18(9-3-4-10-18)21-16(23)12-20-14-6-1-2-7-15(14)22-11-5-8-17(22)24/h1-2,6-7,20H,3-5,8-12H2,(H,21,23)
InChIKeyOOHXBDNSLVJQNY-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.18
Rot. Bonds5

About N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide

N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide (PubChem CID 26542850) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
PubChem CID26542850
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
SMILESN#CC1(NC(=O)CNc2ccccc2N2CCCC2=O)CCCC1
InChIInChI=1S/C18H22N4O2/c19-13-18(9-3-4-10-18)21-16(23)12-20-14-6-1-2-7-15(14)22-11-5-8-17(22)24/h1-2,6-7,20H,3-5,8-12H2,(H,21,23)
InChIKeyOOHXBDNSLVJQNY-UHFFFAOYSA-N
XLogP2.18
TPSA85.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyanocycloheptyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 46534675
N-(2,6-dimethylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 17491113
4-[[2-[2-(2-oxopyrrolidin-1-yl)anilino]acetyl]amino]benzamide
CID 17497451
N-(1-methoxypropan-2-yl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 51260899
2-[2-(2-oxopyrrolidin-1-yl)anilino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 26542736
N-(2-ethyl-6-methylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 26542779
N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide
CID 47064203
2-(methylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide;hydrochloride
CID 119693883
N-[2-(2-oxopyrrolidin-1-yl)phenyl]-2-(prop-2-ynylamino)acetamide
CID 112722701
N-(1-cyanocyclopentyl)-2-[2-(N-methylanilino)anilino]acetamide
CID 47064157
N-(2-methyl-3-nitrophenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 17489416
1-[2-(benzylamino)phenyl]pyrrolidin-2-one
CID 28682033

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide (CID 26542850) is N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide is N#CC1(NC(=O)CNc2ccccc2N2CCCC2=O)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide?
The InChIKey is OOHXBDNSLVJQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c19-13-18(9-3-4-10-18)21-16(23)12-20-14-6-1-2-7-15(14)22-11-5-8-17(22)24/h1-2,6-7,20H,3-5,8-12H2,(H,21,23).
What are the key properties of N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide?
N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide has a molecular weight of 326.40 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide is sourced from PubChem (CID 26542850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).