[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone

C15H23N3O3 — CID 131651452

IUPAC[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone
SMILESCc1nocc1C(=O)N1CCC2(CC1)CC(N(C)C)CO2
InChIInChI=1S/C15H23N3O3/c1-11-13(10-21-16-11)14(19)18-6-4-15(5-7-18)8-12(9-20-15)17(2)3/h10,12H,4-9H2,1-3H3
InChIKeyQMRIXNXKSMBLBD-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.31
Rot. Bonds2

About [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone

[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone (PubChem CID 131651452) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone.

Molecular Properties

Compound Name[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone
PubChem CID131651452
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone
SMILESCc1nocc1C(=O)N1CCC2(CC1)CC(N(C)C)CO2
InChIInChI=1S/C15H23N3O3/c1-11-13(10-21-16-11)14(19)18-6-4-15(5-7-18)8-12(9-20-15)17(2)3/h10,12H,4-9H2,1-3H3
InChIKeyQMRIXNXKSMBLBD-UHFFFAOYSA-N
XLogP1.31
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[(3S)-3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-pyridazin-4-ylmethanone
CID 97450581
[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(furan-2-yl)methanone
CID 133141655
(3-methyl-1,2-oxazol-4-yl)-[3-(morpholin-4-ylmethyl)-1-oxa-9-azaspiro[4.5]decan-9-yl]methanone
CID 134072585
[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-hydroxycyclobutyl)methanone
CID 131690369
ethyl 4-(3-methyl-1,2-oxazole-4-carbonyl)piperazine-1-carboxylate
CID 110853959
[(3R)-3-(N-methylanilino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(4-methyl-1,3-oxazol-5-yl)methanone
CID 125006667
[(1R,2R)-2-methylcyclopropyl]-[7-(3-methyl-1,2-oxazole-4-carbonyl)-3-propan-2-yl-2,7-diazaspiro[3.5]nonan-2-yl]methanone
CID 167772991
1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one
CID 97493798
[(3R)-3-(4-fluoro-N-methylanilino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(6-methyl-2-pyridinyl)methanone
CID 124944438
1-[3-(N-methylanilino)-1-oxa-8-azaspiro[4.5]decan-8-yl]ethanone
CID 110131133
1-[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decane-8-carbonyl]cyclopentane-1-carbonitrile
CID 131690386
(2-amino-4-methyl-1,3-thiazol-5-yl)-[(3R)-3-(N-methylanilino)-1-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 125025083

Frequently Asked Questions

What is the IUPAC name of [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone?
The IUPAC name of [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone (CID 131651452) is [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone.
What is the SMILES notation for [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone?
The canonical SMILES for [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone is Cc1nocc1C(=O)N1CCC2(CC1)CC(N(C)C)CO2.
What is the InChIKey of [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone?
The InChIKey is QMRIXNXKSMBLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-11-13(10-21-16-11)14(19)18-6-4-15(5-7-18)8-12(9-20-15)17(2)3/h10,12H,4-9H2,1-3H3.
What are the key properties of [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone?
[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone has a molecular weight of 293.37 g/mol, XLogP of 1.31, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone is sourced from PubChem (CID 131651452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).