2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide

C21H23N3O4 — CID 118778157

IUPAC2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
SMILESO=C1NCC2(CCN(C(=O)Nc3ccccc3OCc3ccccc3)CC2)O1
InChIInChI=1S/C21H23N3O4/c25-19(24-12-10-21(11-13-24)15-22-20(26)28-21)23-17-8-4-5-9-18(17)27-14-16-6-2-1-3-7-16/h1-9H,10-15H2,(H,22,26)(H,23,25)
InChIKeyXSKYEGRGRGHOGT-UHFFFAOYSA-N
MW381.43 g/mol
LogP3.37
Rot. Bonds4

About 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide

2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 118778157) has the molecular formula C21H23N3O4 and a molecular weight of 381.43 g/mol. Its IUPAC name is 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID118778157
Molecular FormulaC21H23N3O4
Molecular Weight381.43 g/mol
Exact Mass381.17
IUPAC Name2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
SMILESO=C1NCC2(CCN(C(=O)Nc3ccccc3OCc3ccccc3)CC2)O1
InChIInChI=1S/C21H23N3O4/c25-19(24-12-10-21(11-13-24)15-22-20(26)28-21)23-17-8-4-5-9-18(17)27-14-16-6-2-1-3-7-16/h1-9H,10-15H2,(H,22,26)(H,23,25)
InChIKeyXSKYEGRGRGHOGT-UHFFFAOYSA-N
XLogP3.37
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(4R)-4-hydroxy-4-methyl-N-(2-phenylmethoxyphenyl)azepane-1-carboxamide
CID 125166380
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CID 138387517
N-[2-methoxy-5-(methylcarbamoyl)phenyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
CID 118760794
(3S)-3-hydroxy-3-(hydroxymethyl)-N-[2-(3-phenylpropoxy)phenyl]pyrrolidine-1-carboxamide
CID 125167089
N-(4-methoxy-7-phenyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
CID 159454171
N-[(1R)-1-(4-ethylphenyl)ethyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
CID 126432772
8-(2-chlorobenzoyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 110668800
8-[2-[4-(quinolin-2-ylmethoxy)phenyl]acetyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 160647082
4-benzyl-N-(2-ethoxyphenyl)piperazine-1-carboxamide
CID 6468674
2-oxo-N-[3-(tetrazol-1-yl)phenyl]-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
CID 118790013
8-[(4-chlorophenyl)-(4-phenylmethoxyphenyl)methyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 149431956
1-(4-benzylpiperazin-1-yl)-N-(2-phenylmethoxyphenyl)cyclopropane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide (CID 118778157) is 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide is O=C1NCC2(CCN(C(=O)Nc3ccccc3OCc3ccccc3)CC2)O1.
What is the InChIKey of 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is XSKYEGRGRGHOGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O4/c25-19(24-12-10-21(11-13-24)15-22-20(26)28-21)23-17-8-4-5-9-18(17)27-14-16-6-2-1-3-7-16/h1-9H,10-15H2,(H,22,26)(H,23,25).
What are the key properties of 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide?
2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 381.43 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(2-phenylmethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 118778157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).