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

C15H27N5O — CID 63265641

IUPACN-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide
SMILESCN(CCN1CCNCC1)CC(=O)NC1(C#N)CCCC1
InChIInChI=1S/C15H27N5O/c1-19(10-11-20-8-6-17-7-9-20)12-14(21)18-15(13-16)4-2-3-5-15/h17H,2-12H2,1H3,(H,18,21)
InChIKeyPTVVREXNCLHHRV-UHFFFAOYSA-N
MW293.41 g/mol
LogP-0.22
Rot. Bonds6

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

N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide (PubChem CID 63265641) has the molecular formula C15H27N5O and a molecular weight of 293.41 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide
PubChem CID63265641
Molecular FormulaC15H27N5O
Molecular Weight293.41 g/mol
Exact Mass293.22
IUPAC NameN-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide
SMILESCN(CCN1CCNCC1)CC(=O)NC1(C#N)CCCC1
InChIInChI=1S/C15H27N5O/c1-19(10-11-20-8-6-17-7-9-20)12-14(21)18-15(13-16)4-2-3-5-15/h17H,2-12H2,1H3,(H,18,21)
InChIKeyPTVVREXNCLHHRV-UHFFFAOYSA-N
XLogP-0.22
TPSA71.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-cyanocyclohexyl)-2-piperazin-1-ylacetamide
CID 43090468
2-[2-aminoethyl(methyl)amino]-N-(1-cyanocyclohexyl)acetamide
CID 62687725
N-(1-cyanocyclohexyl)-2-[ethyl(methyl)amino]acetamide
CID 60516717
methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl]-methylamino]acetate
CID 60660513
N-(1-cyanocyclohexyl)-2-(1,4-diazepan-1-yl)acetamide
CID 43340980
N-(1-cyanocycloheptyl)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]acetamide
CID 134018511
methyl N-[2-[methyl(2-piperazin-1-ylethyl)amino]acetyl]carbamate
CID 55167527
N-(1-cyanocycloheptyl)-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
CID 134018510
N-(2-methyl-4-oxopentan-3-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide
CID 63265483
4-[[2-[methyl(2-piperazin-1-ylethyl)amino]acetyl]amino]butanoic acid
CID 63265218
2-[methyl(2-pyrrolidin-1-ylethyl)amino]acetohydrazide
CID 63573409
N-(1-cyanocyclopentyl)-2-[(2S)-2-methylpiperazin-1-yl]acetamide
CID 82755298

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide (CID 63265641) is N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide is CN(CCN1CCNCC1)CC(=O)NC1(C#N)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide?
The InChIKey is PTVVREXNCLHHRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-19(10-11-20-8-6-17-7-9-20)12-14(21)18-15(13-16)4-2-3-5-15/h17H,2-12H2,1H3,(H,18,21).
What are the key properties of N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide?
N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide has a molecular weight of 293.41 g/mol, XLogP of -0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide is sourced from PubChem (CID 63265641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).