N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide

C17H23N3O — CID 51073006

IUPACN-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide
SMILESCC(c1ccccc1)N(C)CC(=O)NC1(C#N)CCCC1
InChIInChI=1S/C17H23N3O/c1-14(15-8-4-3-5-9-15)20(2)12-16(21)19-17(13-18)10-6-7-11-17/h3-5,8-9,14H,6-7,10-12H2,1-2H3,(H,19,21)
InChIKeyNULKGOGGYJSEQB-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.63
Rot. Bonds5

About N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide

N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide (PubChem CID 51073006) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide
PubChem CID51073006
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide
SMILESCC(c1ccccc1)N(C)CC(=O)NC1(C#N)CCCC1
InChIInChI=1S/C17H23N3O/c1-14(15-8-4-3-5-9-15)20(2)12-16(21)19-17(13-18)10-6-7-11-17/h3-5,8-9,14H,6-7,10-12H2,1-2H3,(H,19,21)
InChIKeyNULKGOGGYJSEQB-UHFFFAOYSA-N
XLogP2.63
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(1R)-1-(4-chlorophenyl)ethyl]-methylamino]-N-(1-cyanocyclopentyl)acetamide
CID 95934995
N-(1-cyanocycloheptyl)-2-[N-(2-hydroxypropyl)anilino]acetamide
CID 51106356
2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide
CID 60500149
2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide
CID 7516068
N-(1-cyanocyclopentyl)-2-(dibenzylamino)acetamide
CID 51170595
2-[benzyl-(1-hydroxy-3-methylbutan-2-yl)amino]-N-(1-cyanocyclopentyl)acetamide
CID 111432016
N-(1-cyanocyclopentyl)-2-[[(2R)-1-(4-methoxyphenyl)propan-2-yl]-methylamino]acetamide
CID 95158339
2-[benzyl(ethyl)amino]-N-(1-cyanocyclohexyl)acetamide
CID 18129609
[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] (2R,3R)-3-methyl-2-phenylpentanoate
CID 7773143
[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] (2S)-2-hydroxy-2-phenylacetate
CID 7834274
N-(1-cyanocyclohexyl)-2,2-diphenylacetamide
CID 78830716
N-(1-cyanocycloheptyl)-2-phenylsulfanylacetamide
CID 47149296

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide (CID 51073006) is N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide is CC(c1ccccc1)N(C)CC(=O)NC1(C#N)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide?
The InChIKey is NULKGOGGYJSEQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-14(15-8-4-3-5-9-15)20(2)12-16(21)19-17(13-18)10-6-7-11-17/h3-5,8-9,14H,6-7,10-12H2,1-2H3,(H,19,21).
What are the key properties of N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide?
N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide has a molecular weight of 285.39 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide is sourced from PubChem (CID 51073006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).