9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one

C15H23N3O3 — CID 131948571

IUPAC9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
SMILESCC(C)c1nc(CN2CCC3(C2)CN(C)C(=O)CO3)co1
InChIInChI=1S/C15H23N3O3/c1-11(2)14-16-12(7-20-14)6-18-5-4-15(10-18)9-17(3)13(19)8-21-15/h7,11H,4-6,8-10H2,1-3H3
InChIKeyCZZJHEWZRALCCY-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.23
Rot. Bonds3

About 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one

9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one (PubChem CID 131948571) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one.

Molecular Properties

Compound Name9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
PubChem CID131948571
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
SMILESCC(C)c1nc(CN2CCC3(C2)CN(C)C(=O)CO3)co1
InChIInChI=1S/C15H23N3O3/c1-11(2)14-16-12(7-20-14)6-18-5-4-15(10-18)9-17(3)13(19)8-21-15/h7,11H,4-6,8-10H2,1-3H3
InChIKeyCZZJHEWZRALCCY-UHFFFAOYSA-N
XLogP1.23
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1'-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]spiro[1H-indole-3,4'-piperidine]-2-one
CID 77080326
(5S)-3-methyl-9-[(2-methyl-1,3-oxazol-4-yl)methyl]-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 95717355
8-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-1,3,4,6,7,9a-hexahydropyrazino[1,2-a]pyrazin-9-one
CID 74232786
formic acid;4-methyl-9-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 154906890
9-[(2-methyl-1,3-oxazol-4-yl)methyl]-1-oxa-9-azaspiro[4.6]undecan-8-one
CID 56863029
(4aS,8aR)-1-(3-aminopropyl)-6-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one
CID 56885270
4-(1,4-diazepan-1-ylmethyl)-2-propan-2-yl-1,3-oxazole;dihydrochloride
CID 154904151
(5R)-7-[(2-methyl-1,3-oxazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane-1,3-dione
CID 96576097
(4aS,8aR)-1-(3-aminopropyl)-6-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one;dihydrochloride
CID 154885383
(6S)-10-(2-methoxyethyl)-1-methyl-4-[(2-methyl-1,3-oxazol-4-yl)methyl]-1,4,10-triazaspiro[5.6]dodecan-9-one
CID 97130711
9-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]-8-oxo-6-oxa-2,9-diazaspiro[4.5]decane-2-carboxamide
CID 121495253
3-methyl-7-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]-1-oxa-3,7-diazaspiro[4.4]nonan-2-one
CID 56912482

Frequently Asked Questions

What is the IUPAC name of 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one?
The IUPAC name of 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one (CID 131948571) is 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one.
What is the SMILES notation for 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one?
The canonical SMILES for 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one is CC(C)c1nc(CN2CCC3(C2)CN(C)C(=O)CO3)co1.
What is the InChIKey of 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one?
The InChIKey is CZZJHEWZRALCCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-11(2)14-16-12(7-20-14)6-18-5-4-15(10-18)9-17(3)13(19)8-21-15/h7,11H,4-6,8-10H2,1-3H3.
What are the key properties of 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one?
9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one has a molecular weight of 293.37 g/mol, XLogP of 1.23, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-2-[(2-propan-2-yl-1,3-oxazol-4-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one is sourced from PubChem (CID 131948571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).