N-(3-butoxypropyl)-2-cyclopentylacetamide

C14H27NO2 — CID 78785153

IUPACN-(3-butoxypropyl)-2-cyclopentylacetamide
SMILESCCCCOCCCNC(=O)CC1CCCC1
InChIInChI=1S/C14H27NO2/c1-2-3-10-17-11-6-9-15-14(16)12-13-7-4-5-8-13/h13H,2-12H2,1H3,(H,15,16)
InChIKeyJSGZAVVWIZUYLO-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.89
Rot. Bonds9

About N-(3-butoxypropyl)-2-cyclopentylacetamide

N-(3-butoxypropyl)-2-cyclopentylacetamide (PubChem CID 78785153) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-(3-butoxypropyl)-2-cyclopentylacetamide.

Molecular Properties

Compound NameN-(3-butoxypropyl)-2-cyclopentylacetamide
PubChem CID78785153
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-(3-butoxypropyl)-2-cyclopentylacetamide
SMILESCCCCOCCCNC(=O)CC1CCCC1
InChIInChI=1S/C14H27NO2/c1-2-3-10-17-11-6-9-15-14(16)12-13-7-4-5-8-13/h13H,2-12H2,1H3,(H,15,16)
InChIKeyJSGZAVVWIZUYLO-UHFFFAOYSA-N
XLogP2.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-cyclohexyl-N-octylacetamide
CID 3547359
2-cyclopropyl-N-pentylacetamide
CID 66755217
N-(3-butoxypropyl)-2-(cyclopentylamino)acetamide
CID 113219331
2-cycloheptyl-N-[3-(methylamino)propyl]acetamide;hydrochloride
CID 119432481
2-cyclohexyl-N-[2-[[N-[3-(2-methoxyethoxy)propyl]-N'-methylcarbamimidoyl]amino]ethyl]acetamide;hydroiodide
CID 111407116
N'-(3-butoxypropyl)-N-butylbutanediamide
CID 4602776
2-(3-aminocyclohexyl)-N-(3-ethoxypropyl)acetamide
CID 62783140
3-[(2-cyclopentylacetyl)amino]-N-propylpropanamide
CID 167068164
N-(3-butoxypropyl)-2-(propylamino)acetamide
CID 115574332
N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107148072
2-(azetidin-3-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide
CID 64609560
N-(3-aminopropyl)-2-cyclopentylacetamide
CID 24706958

Frequently Asked Questions

What is the IUPAC name of N-(3-butoxypropyl)-2-cyclopentylacetamide?
The IUPAC name of N-(3-butoxypropyl)-2-cyclopentylacetamide (CID 78785153) is N-(3-butoxypropyl)-2-cyclopentylacetamide.
What is the SMILES notation for N-(3-butoxypropyl)-2-cyclopentylacetamide?
The canonical SMILES for N-(3-butoxypropyl)-2-cyclopentylacetamide is CCCCOCCCNC(=O)CC1CCCC1.
What is the InChIKey of N-(3-butoxypropyl)-2-cyclopentylacetamide?
The InChIKey is JSGZAVVWIZUYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-2-3-10-17-11-6-9-15-14(16)12-13-7-4-5-8-13/h13H,2-12H2,1H3,(H,15,16).
What are the key properties of N-(3-butoxypropyl)-2-cyclopentylacetamide?
N-(3-butoxypropyl)-2-cyclopentylacetamide has a molecular weight of 241.37 g/mol, XLogP of 2.89, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butoxypropyl)-2-cyclopentylacetamide is sourced from PubChem (CID 78785153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).