4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

C15H26N2O3 — CID 42669895

IUPAC4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
SMILESCCCNC(=O)C1COC2(CCCCC2)N1C(=O)CC
InChIInChI=1S/C15H26N2O3/c1-3-10-16-14(19)12-11-20-15(8-6-5-7-9-15)17(12)13(18)4-2/h12H,3-11H2,1-2H3,(H,16,19)
InChIKeyRKAFBYZQAAOILW-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.81
Rot. Bonds4

About 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide (PubChem CID 42669895) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide.

Molecular Properties

Compound Name4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
PubChem CID42669895
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
SMILESCCCNC(=O)C1COC2(CCCCC2)N1C(=O)CC
InChIInChI=1S/C15H26N2O3/c1-3-10-16-14(19)12-11-20-15(8-6-5-7-9-15)17(12)13(18)4-2/h12H,3-11H2,1-2H3,(H,16,19)
InChIKeyRKAFBYZQAAOILW-UHFFFAOYSA-N
XLogP1.81
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S,5S,7R)-4-(cyclopentanecarbonyl)-7-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 99768198
N-(2-methoxyethyl)-4-(2-phenylacetyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71955880
4-(4-ethylbenzoyl)-N-(2-methoxyethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71956686
(3S)-4-(3-methoxybenzoyl)-8-propanoyl-N-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
CID 97478249
N-(2-methylpropyl)-4-(2-thiophen-2-ylacetyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71956551
4-(3-fluorobenzoyl)-8-methyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71955974
(3R)-4-benzoyl-8-(2-methylbenzoyl)-N-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
CID 93137292
4-benzoyl-N-(2-morpholin-4-ylethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 46110761
8-(4-ethylbenzoyl)-4-(3-methylbenzoyl)-N-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
CID 71956660
(3R)-8-(furan-2-carbonyl)-4-(4-methoxybenzoyl)-N-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
CID 97478105
(3R)-8-(2-chlorobenzoyl)-4-(3-fluorobenzoyl)-N-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
CID 93138542
(3S)-8-(3,4-dichlorobenzoyl)-4-(2-methylbenzoyl)-N-propyl-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
CID 93137867

Frequently Asked Questions

What is the IUPAC name of 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The IUPAC name of 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide (CID 42669895) is 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide.
What is the SMILES notation for 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The canonical SMILES for 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide is CCCNC(=O)C1COC2(CCCCC2)N1C(=O)CC.
What is the InChIKey of 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The InChIKey is RKAFBYZQAAOILW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-3-10-16-14(19)12-11-20-15(8-6-5-7-9-15)17(12)13(18)4-2/h12H,3-11H2,1-2H3,(H,16,19).
What are the key properties of 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide has a molecular weight of 282.38 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propanoyl-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 42669895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).