(5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide

C15H20N2O3 — CID 98896788

IUPAC(5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide
SMILESCNC(=O)[C@H]1CCC[C@]12CCN(C(=O)c1ccco1)C2
InChIInChI=1S/C15H20N2O3/c1-16-13(18)11-4-2-6-15(11)7-8-17(10-15)14(19)12-5-3-9-20-12/h3,5,9,11H,2,4,6-8,10H2,1H3,(H,16,18)/t11-,15-/m1/s1
InChIKeyFNEVXBGJOMGPJW-IAQYHMDHSA-N
MW276.34 g/mol
LogP1.66
Rot. Bonds2

About (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide

(5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide (PubChem CID 98896788) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide.

Molecular Properties

Compound Name(5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide
PubChem CID98896788
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name(5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide
SMILESCNC(=O)[C@H]1CCC[C@]12CCN(C(=O)c1ccco1)C2
InChIInChI=1S/C15H20N2O3/c1-16-13(18)11-4-2-6-15(11)7-8-17(10-15)14(19)12-5-3-9-20-12/h3,5,9,11H,2,4,6-8,10H2,1H3,(H,16,18)/t11-,15-/m1/s1
InChIKeyFNEVXBGJOMGPJW-IAQYHMDHSA-N
XLogP1.66
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5S,9R)-N-methyl-2-(5-methylfuran-2-carbonyl)-2-azaspiro[4.4]nonane-9-carboxamide
CID 125215989
(5S,9S)-N-methyl-2-(4-methylpyridine-3-carbonyl)-2-azaspiro[4.4]nonane-9-carboxamide
CID 98895593
(3aS,6aS)-2-acetyl-1'-(furan-2-carbonyl)-N-methylspiro[3,4,5,6a-tetrahydro-1H-cyclopenta[c]pyrrole-6,4'-piperidine]-3a-carboxamide
CID 97360301
[(5S,10S)-10-fluoro-7-methylsulfonyl-2,7-diazaspiro[4.5]decan-2-yl]-(furan-2-yl)methanone
CID 124522121
2-(furan-2-carbonyl)-N-propan-2-yl-8-oxa-2-azaspiro[4.5]decane-4-carboxamide
CID 118741205
(2R,3S)-N-methyl-5-(1,2-oxazole-5-carbonyl)-5-azaspiro[2.4]heptane-2-carboxamide
CID 97492507
3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone
CID 62867411
2-[8-(furan-2-carbonyl)-1,8-diazaspiro[4.5]decan-1-yl]-N-methylacetamide
CID 97493598
(3R)-1-(furan-2-carbonyl)-3-methylpyrrolidine-3-carboxylic acid
CID 95020168
1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide
CID 9374659
azepan-1-yl(furan-2-yl)methanone
CID 5200992
furan-2-yl-(3-pyrrolidin-1-yl-1-oxa-8-azaspiro[4.5]decan-8-yl)methanone
CID 131647701

Frequently Asked Questions

What is the IUPAC name of (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide?
The IUPAC name of (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide (CID 98896788) is (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide.
What is the SMILES notation for (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide?
The canonical SMILES for (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide is CNC(=O)[C@H]1CCC[C@]12CCN(C(=O)c1ccco1)C2.
What is the InChIKey of (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide?
The InChIKey is FNEVXBGJOMGPJW-IAQYHMDHSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-16-13(18)11-4-2-6-15(11)7-8-17(10-15)14(19)12-5-3-9-20-12/h3,5,9,11H,2,4,6-8,10H2,1H3,(H,16,18)/t11-,15-/m1/s1.
What are the key properties of (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide?
(5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,9S)-2-(furan-2-carbonyl)-N-methyl-2-azaspiro[4.4]nonane-9-carboxamide is sourced from PubChem (CID 98896788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).