N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide

C19H19N3O3 — CID 57435795

IUPACN-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide
SMILESO=C(NN1C(c2ccccc2)=NOC12CCOCC2)c1ccccc1
InChIInChI=1S/C19H19N3O3/c23-18(16-9-5-2-6-10-16)20-22-17(15-7-3-1-4-8-15)21-25-19(22)11-13-24-14-12-19/h1-10H,11-14H2,(H,20,23)
InChIKeyVIZCMIBULULRDA-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.53
Rot. Bonds3

About N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide

N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide (PubChem CID 57435795) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide.

Molecular Properties

Compound NameN-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide
PubChem CID57435795
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide
SMILESO=C(NN1C(c2ccccc2)=NOC12CCOCC2)c1ccccc1
InChIInChI=1S/C19H19N3O3/c23-18(16-9-5-2-6-10-16)20-22-17(15-7-3-1-4-8-15)21-25-19(22)11-13-24-14-12-19/h1-10H,11-14H2,(H,20,23)
InChIKeyVIZCMIBULULRDA-UHFFFAOYSA-N
XLogP2.53
TPSA63.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethyl-N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide
CID 57435794
2-phenoxy-N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)acetamide
CID 57435797
N-[3-(3,5-dimethylphenyl)-1-oxa-2,4-diazaspiro[4.4]non-2-en-4-yl]benzamide
CID 24872210
N-[3-(1,3-benzodioxol-5-yl)-5,5-dimethyl-1,2,4-oxadiazol-4-yl]benzamide
CID 10404917
N-(3-oxomorpholin-4-yl)benzamide
CID 142776527
sodium;5,5-dimethyl-3-phenyl-1,2,4-oxadiazol-4-amine;N-(5,5-dimethyl-3-phenyl-1,2,4-oxadiazol-4-yl)-4-ethylbenzamide;4-ethylbenzoyl chloride;methane;hydroxide
CID 161306939
(4-benzamidooxan-4-yl) acetate
CID 69498261
N-benzoyl-1-oxa-4,10-dithia-7-azacyclododecane-7-carboxamide
CID 86096997
N-(2-morpholin-4-ylethylcarbamoyl)benzamide
CID 2987060
N-hydroxy-4-[(4-phenylphenyl)methoxy]oxane-4-carboxamide
CID 87317670
N-[(Z)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-morpholin-4-yl-3-oxo-1-phenylprop-1-en-2-yl]benzamide
CID 1047012
N-[(1R,2R,6R,7R)-3,5-dioxospiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-4-yl]benzamide
CID 124536832

Frequently Asked Questions

What is the IUPAC name of N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide?
The IUPAC name of N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide (CID 57435795) is N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide.
What is the SMILES notation for N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide?
The canonical SMILES for N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide is O=C(NN1C(c2ccccc2)=NOC12CCOCC2)c1ccccc1.
What is the InChIKey of N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide?
The InChIKey is VIZCMIBULULRDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c23-18(16-9-5-2-6-10-16)20-22-17(15-7-3-1-4-8-15)21-25-19(22)11-13-24-14-12-19/h1-10H,11-14H2,(H,20,23).
What are the key properties of N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide?
N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide has a molecular weight of 337.38 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenyl-1,8-dioxa-2,4-diazaspiro[4.5]dec-2-en-4-yl)benzamide is sourced from PubChem (CID 57435795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).