N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide

C15H30N2O2 — CID 107148072

IUPACN-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide
SMILESCCCCOCCCNC(=O)CC1NCCCC1C
InChIInChI=1S/C15H30N2O2/c1-3-4-10-19-11-6-9-17-15(18)12-14-13(2)7-5-8-16-14/h13-14,16H,3-12H2,1-2H3,(H,17,18)
InChIKeyLVWIJGSGPMUYGY-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.09
Rot. Bonds9

About N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide

N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide (PubChem CID 107148072) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide
PubChem CID107148072
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide
SMILESCCCCOCCCNC(=O)CC1NCCCC1C
InChIInChI=1S/C15H30N2O2/c1-3-4-10-19-11-6-9-17-15(18)12-14-13(2)7-5-8-16-14/h13-14,16H,3-12H2,1-2H3,(H,17,18)
InChIKeyLVWIJGSGPMUYGY-UHFFFAOYSA-N
XLogP2.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.09
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-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147985
N-(3-butoxypropyl)-2-cyclopentylacetamide
CID 78785153
N-[(3-methylpiperidin-2-yl)methyl]-2-propoxyacetamide
CID 107938590
N-octyl-2-pyrrolidin-2-ylacetamide
CID 115567860
N,N-dibutyl-2-(3-methylpiperidin-2-yl)acetamide
CID 107147528
N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide
CID 114174284
N-(2-methylcyclohexyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147462
N-(3-methylcyclopentyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107148093
N'-(3-butoxypropyl)-N-butylbutanediamide
CID 4602776
N-(3-butoxypropyl)-2-(cyclopentylamino)acetamide
CID 113219331
1-[(3-methylpiperidin-2-yl)methyl]-3-propylurea
CID 63304890
(3R)-N-(3-butoxypropyl)piperidine-3-carboxamide
CID 113481104

Frequently Asked Questions

What is the IUPAC name of N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide (CID 107148072) is N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide is CCCCOCCCNC(=O)CC1NCCCC1C.
What is the InChIKey of N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide?
The InChIKey is LVWIJGSGPMUYGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-3-4-10-19-11-6-9-17-15(18)12-14-13(2)7-5-8-16-14/h13-14,16H,3-12H2,1-2H3,(H,17,18).
What are the key properties of N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide?
N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide has a molecular weight of 270.42 g/mol, XLogP of 2.09, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 107148072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).