N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide

C19H25N3O2 — CID 47064203

IUPACN-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide
SMILESN#CC1(NC(=O)CNc2ccccc2OC2CCCC2)CCCC1
InChIInChI=1S/C19H25N3O2/c20-14-19(11-5-6-12-19)22-18(23)13-21-16-9-3-4-10-17(16)24-15-7-1-2-8-15/h3-4,9-10,15,21H,1-2,5-8,11-13H2,(H,22,23)
InChIKeyAVBVMGRCMNYBHV-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.37
Rot. Bonds6

About N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide

N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide (PubChem CID 47064203) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide
PubChem CID47064203
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide
SMILESN#CC1(NC(=O)CNc2ccccc2OC2CCCC2)CCCC1
InChIInChI=1S/C19H25N3O2/c20-14-19(11-5-6-12-19)22-18(23)13-21-16-9-3-4-10-17(16)24-15-7-1-2-8-15/h3-4,9-10,15,21H,1-2,5-8,11-13H2,(H,22,23)
InChIKeyAVBVMGRCMNYBHV-UHFFFAOYSA-N
XLogP3.37
TPSA74.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-benzylanilino)-N-(1-cyanocyclopentyl)acetamide
CID 33163851
N-(1-cyanocyclopentyl)-2-[2-(N-methylanilino)anilino]acetamide
CID 47064157
2-(3-chloro-2-fluoroanilino)-N-(1-cyanocyclohexyl)acetamide
CID 33164628
N-(1-cyanocyclohexyl)-2-[2-[[dimethyl(oxo)-λ6-sulfanylidene]amino]anilino]acetamide
CID 126841359
N-(1-cyanocyclopentyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 26542850
methyl 4-[[2-(2-cyclopentyloxyanilino)acetyl]amino]benzoate
CID 60536886
N-(3-chlorophenyl)-2-(2-cyclopentyloxyanilino)acetamide
CID 52704421
N-(1-cyanocycloheptyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 46534675
N-(1-cyanocycloheptyl)-2-(2,6-dimethylanilino)acetamide
CID 32908656
N-(1-cyanocycloheptyl)-2-(2,4-dibromoanilino)acetamide
CID 55532584
N-(1-cyanocyclohexyl)-2-(2,4-dimethylanilino)acetamide
CID 51183021
2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide
CID 26507758

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide (CID 47064203) is N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide is N#CC1(NC(=O)CNc2ccccc2OC2CCCC2)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide?
The InChIKey is AVBVMGRCMNYBHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c20-14-19(11-5-6-12-19)22-18(23)13-21-16-9-3-4-10-17(16)24-15-7-1-2-8-15/h3-4,9-10,15,21H,1-2,5-8,11-13H2,(H,22,23).
What are the key properties of N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide?
N-(1-cyanocyclopentyl)-2-(2-cyclopentyloxyanilino)acetamide has a molecular weight of 327.43 g/mol, XLogP of 3.37, 6 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-cyclopentyloxyanilino)acetamide is sourced from PubChem (CID 47064203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).