(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone

C23H30N4O3 — CID 135118204

IUPAC(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone
SMILESCN1CCC2(CCN(C(=O)c3c(N4CCOCC4)noc3-c3ccccc3)CC2)C1
InChIInChI=1S/C23H30N4O3/c1-25-10-7-23(17-25)8-11-27(12-9-23)22(28)19-20(18-5-3-2-4-6-18)30-24-21(19)26-13-15-29-16-14-26/h2-6H,7-17H2,1H3
InChIKeyXMQMMAPLCRJQCU-UHFFFAOYSA-N
MW410.52 g/mol
LogP2.74
Rot. Bonds3

About (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone

(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone (PubChem CID 135118204) has the molecular formula C23H30N4O3 and a molecular weight of 410.52 g/mol. Its IUPAC name is (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone.

Molecular Properties

Compound Name(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone
PubChem CID135118204
Molecular FormulaC23H30N4O3
Molecular Weight410.52 g/mol
Exact Mass410.23
IUPAC Name(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone
SMILESCN1CCC2(CCN(C(=O)c3c(N4CCOCC4)noc3-c3ccccc3)CC2)C1
InChIInChI=1S/C23H30N4O3/c1-25-10-7-23(17-25)8-11-27(12-9-23)22(28)19-20(18-5-3-2-4-6-18)30-24-21(19)26-13-15-29-16-14-26/h2-6H,7-17H2,1H3
InChIKeyXMQMMAPLCRJQCU-UHFFFAOYSA-N
XLogP2.74
TPSA62.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.52
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Launch Full Analysis

Related Compounds

2-azaspiro[4.6]undecan-2-yl-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone
CID 135092562
(4-aminopiperidin-1-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone
CID 135087587
4-(3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carbonyl)piperazin-2-one
CID 135096385
N-[(3S)-1-(3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carbonyl)pyrrolidin-3-yl]acetamide
CID 135088868
[2-(aminomethyl)morpholin-4-yl]-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone;hydrochloride
CID 154916307
2-azaspiro[4.4]nonan-2-yl-[5-(4-methoxyphenyl)-3-pyrrolidin-1-yl-1,2-oxazol-4-yl]methanone
CID 135118686
[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone
CID 135099423
N-[1-(hydroxymethyl)cyclohexyl]-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide
CID 135115347
5-(4-chlorophenyl)-3-morpholin-4-yl-1,2-oxazole-4-carboxylic acid
CID 163314828
N-[[1-(methoxymethyl)cyclobutyl]methyl]-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide
CID 135120437
N-[(1R,2R)-2-(dimethylamino)cyclopentyl]-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide
CID 135119391
N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide
CID 135119979

Frequently Asked Questions

What is the IUPAC name of (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone?
The IUPAC name of (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone (CID 135118204) is (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone.
What is the SMILES notation for (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone?
The canonical SMILES for (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone is CN1CCC2(CCN(C(=O)c3c(N4CCOCC4)noc3-c3ccccc3)CC2)C1.
What is the InChIKey of (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone?
The InChIKey is XMQMMAPLCRJQCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O3/c1-25-10-7-23(17-25)8-11-27(12-9-23)22(28)19-20(18-5-3-2-4-6-18)30-24-21(19)26-13-15-29-16-14-26/h2-6H,7-17H2,1H3.
What are the key properties of (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone?
(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone has a molecular weight of 410.52 g/mol, XLogP of 2.74, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-2,8-diazaspiro[4.5]decan-8-yl)-(3-morpholin-4-yl-5-phenyl-1,2-oxazol-4-yl)methanone is sourced from PubChem (CID 135118204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).