N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide

C15H28N2O3 — CID 102930304

IUPACN-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
SMILESCCCCNC(=O)C(C)OC1COC2(CCNCC2)C1
InChIInChI=1S/C15H28N2O3/c1-3-4-7-17-14(18)12(2)20-13-10-15(19-11-13)5-8-16-9-6-15/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyBGLGJAVGTNTTKV-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.22
Rot. Bonds6

About N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide

N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide (PubChem CID 102930304) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide.

Molecular Properties

Compound NameN-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
PubChem CID102930304
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC NameN-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
SMILESCCCCNC(=O)C(C)OC1COC2(CCNCC2)C1
InChIInChI=1S/C15H28N2O3/c1-3-4-7-17-14(18)12(2)20-13-10-15(19-11-13)5-8-16-9-6-15/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyBGLGJAVGTNTTKV-UHFFFAOYSA-N
XLogP1.22
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
CID 102930345
2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)-N-propan-2-ylpropanamide
CID 102930305
methyl 2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanoate
CID 106941120
2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pentanoic acid
CID 106941098
1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate
CID 102930703
N-pentyl-2-pyrrolidin-3-yloxypropanamide
CID 62327735
N,N-dimethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)acetamide
CID 102930339
2-[(3S)-piperidin-3-yl]oxy-N-propylpropanamide
CID 66245011
N-tert-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)acetamide
CID 102930376
2-[1-(aminomethyl)-3-methylcyclohexyl]oxy-N-butylpropanamide
CID 65052926
N-hexyl-2-[1-(hexylamino)-1-oxopropan-2-yl]oxypropanamide
CID 175959027
1-oxa-8-azaspiro[4.5]decan-3-yl N-cyclobutylcarbamate
CID 102930707

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide?
The IUPAC name of N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide (CID 102930304) is N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide.
What is the SMILES notation for N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide?
The canonical SMILES for N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide is CCCCNC(=O)C(C)OC1COC2(CCNCC2)C1.
What is the InChIKey of N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide?
The InChIKey is BGLGJAVGTNTTKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-3-4-7-17-14(18)12(2)20-13-10-15(19-11-13)5-8-16-9-6-15/h12-13,16H,3-11H2,1-2H3,(H,17,18).
What are the key properties of N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide?
N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide has a molecular weight of 284.40 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide is sourced from PubChem (CID 102930304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).