2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide

C15H16N4O — CID 26507758

IUPAC2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide
SMILESN#Cc1ccc(NCC(=O)NC2(C#N)CCCC2)cc1
InChIInChI=1S/C15H16N4O/c16-9-12-3-5-13(6-4-12)18-10-14(20)19-15(11-17)7-1-2-8-15/h3-6,18H,1-2,7-8,10H2,(H,19,20)
InChIKeyAOWYXNYVHMKGMB-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.92
Rot. Bonds4

About 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide

2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide (PubChem CID 26507758) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide.

Molecular Properties

Compound Name2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide
PubChem CID26507758
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide
SMILESN#Cc1ccc(NCC(=O)NC2(C#N)CCCC2)cc1
InChIInChI=1S/C15H16N4O/c16-9-12-3-5-13(6-4-12)18-10-14(20)19-15(11-17)7-1-2-8-15/h3-6,18H,1-2,7-8,10H2,(H,19,20)
InChIKeyAOWYXNYVHMKGMB-UHFFFAOYSA-N
XLogP1.92
TPSA88.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyanocyclopentyl)-2-(4-cyanophenyl)sulfanylacetamide
CID 51085302
N-(1-cyanocyclopentyl)-3-(4-cyanophenyl)propanamide
CID 78830549
N-(1-cyanocyclohexyl)-2-[4-(difluoromethoxy)anilino]acetamide
CID 36586094
N-(1-cyanocyclohexyl)-2-(3,5-dichloroanilino)acetamide
CID 51183090
N-(1-cyanocyclohexyl)-2-[3-(hydroxymethyl)anilino]acetamide
CID 110877972
2-[4-chloro-3-(trifluoromethyl)anilino]-N-(1-cyanocyclopentyl)acetamide
CID 37479013
N-(1-cyanocycloheptyl)-2-[(2-methyl-1,3-dioxoisoindol-5-yl)amino]acetamide
CID 33005767
methyl 2-chloro-5-[[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl]amino]benzoate
CID 37230490
2-(4-cyanoanilino)-N-[2-[[2-(4-cyanoanilino)acetyl]amino]cyclopentyl]acetamide
CID 166192867
N-(1-cyanocycloheptyl)-2-(2,6-dimethylanilino)acetamide
CID 32908656
2-(4-chloro-3-nitroanilino)-N-(1-cyanocyclohexyl)acetamide
CID 37478786
N-carbamoyl-2-(4-cyanoanilino)acetamide
CID 26507718

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide?
The IUPAC name of 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide (CID 26507758) is 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide.
What is the SMILES notation for 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide?
The canonical SMILES for 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide is N#Cc1ccc(NCC(=O)NC2(C#N)CCCC2)cc1.
What is the InChIKey of 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide?
The InChIKey is AOWYXNYVHMKGMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c16-9-12-3-5-13(6-4-12)18-10-14(20)19-15(11-17)7-1-2-8-15/h3-6,18H,1-2,7-8,10H2,(H,19,20).
What are the key properties of 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide?
2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide has a molecular weight of 268.32 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanoanilino)-N-(1-cyanocyclopentyl)acetamide is sourced from PubChem (CID 26507758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).