N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide

C16H31N3O — CID 67073869

IUPACN-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide
SMILESCC1CN(CC(=O)NCCCC2CCCC2)C(C)CN1
InChIInChI=1S/C16H31N3O/c1-13-11-19(14(2)10-18-13)12-16(20)17-9-5-8-15-6-3-4-7-15/h13-15,18H,3-12H2,1-2H3,(H,17,20)
InChIKeyGSEGUMSTGFQWMG-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.76
Rot. Bonds6

About N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide

N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide (PubChem CID 67073869) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide
PubChem CID67073869
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide
SMILESCC1CN(CC(=O)NCCCC2CCCC2)C(C)CN1
InChIInChI=1S/C16H31N3O/c1-13-11-19(14(2)10-18-13)12-16(20)17-9-5-8-15-6-3-4-7-15/h13-15,18H,3-12H2,1-2H3,(H,17,20)
InChIKeyGSEGUMSTGFQWMG-UHFFFAOYSA-N
XLogP1.76
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-2-(4-methyl-1-piperidinyl)acetamide hydrochloride
CID 2959553
2-(1,4-diazaspiro[5.5]undecan-4-yl)-N-methyl-N-pentylacetamide
CID 49853579
N-(3-cyclopentylpropyl)-2-(4-methyl-1,4-diazepan-1-yl)acetamide
CID 49853984
(6S)-6-(4-aminobutyl)-1-(cyclohexylmethyl)piperazine-2,3-dione
CID 16745886
(6S)-1,6-bis(cyclohexylmethyl)piperazine-2,3-dione
CID 23641167
2-(Cyano-methyl-amino)-N-((S)-2-cyclohexyl-1-methyl-ethyl)-acetamide
CID 44398665
(6S)-1-butyl-6-(cyclohexylmethyl)piperazine-2,3-dione
CID 53299358
N-(2-cyclooctylethyl)-2-piperazin-1-ylpropanamide
CID 49853882
1-[[1-(Cyclopentylmethyl)piperidin-4-yl]methyl]piperazine-2,3-dione
CID 45281022
1-[[1-(2-Cyclopentylethyl)piperidin-4-yl]methyl]piperazine-2,3-dione
CID 45281023
(6R)-6-butyl-1-(4-cyclohexylbutyl)piperazine-2,3-dione
CID 53299353
2-[(1S,5R)-3-(acetamidomethyl)-8-azabicyclo[3.2.1]octan-8-yl]-N-tert-butylacetamide
CID 145452975

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide?
The IUPAC name of N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide (CID 67073869) is N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide is CC1CN(CC(=O)NCCCC2CCCC2)C(C)CN1.
What is the InChIKey of N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide?
The InChIKey is GSEGUMSTGFQWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-13-11-19(14(2)10-18-13)12-16(20)17-9-5-8-15-6-3-4-7-15/h13-15,18H,3-12H2,1-2H3,(H,17,20).
What are the key properties of N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide?
N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide has a molecular weight of 281.44 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)-2-(2,5-dimethylpiperazin-1-yl)acetamide is sourced from PubChem (CID 67073869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).