N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide

C23H25NO4 — CID 131905559

IUPACN-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide
SMILESCN(Cc1ccc(Oc2ccccc2)cc1)C(=O)C1CC(=O)OC12CCCC2
InChIInChI=1S/C23H25NO4/c1-24(22(26)20-15-21(25)28-23(20)13-5-6-14-23)16-17-9-11-19(12-10-17)27-18-7-3-2-4-8-18/h2-4,7-12,20H,5-6,13-16H2,1H3
InChIKeyWKDNPCGDCDYHFW-UHFFFAOYSA-N
MW379.46 g/mol
LogP4.31
Rot. Bonds5

About N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide

N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide (PubChem CID 131905559) has the molecular formula C23H25NO4 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide.

Molecular Properties

Compound NameN-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide
PubChem CID131905559
Molecular FormulaC23H25NO4
Molecular Weight379.46 g/mol
Exact Mass379.18
IUPAC NameN-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide
SMILESCN(Cc1ccc(Oc2ccccc2)cc1)C(=O)C1CC(=O)OC12CCCC2
InChIInChI=1S/C23H25NO4/c1-24(22(26)20-15-21(25)28-23(20)13-5-6-14-23)16-17-9-11-19(12-10-17)27-18-7-3-2-4-8-18/h2-4,7-12,20H,5-6,13-16H2,1H3
InChIKeyWKDNPCGDCDYHFW-UHFFFAOYSA-N
XLogP4.31
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,1,3-benzoxadiazol-5-ylmethyl)-N-methyl-2-oxo-1-oxaspiro[4.4]nonane-4-carboxamide
CID 74245235
N-methyl-2-oxo-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide
CID 131893148
(4R)-N-methyl-2-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide
CID 137065770
(4S)-N,1-dimethyl-2-oxo-N-[(4-phenoxyphenyl)methyl]imidazolidine-4-carboxamide
CID 95862292
N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide
CID 2836718
2-oxo-N-[(3-phenylmethoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide
CID 131951276
N-cyclopropyl-2-oxo-N-(3-phenylprop-2-enyl)-1-oxaspiro[4.5]decane-4-carboxamide
CID 171139697
(3R,4R)-4-hydroxy-N,1-dimethyl-N-[(4-phenoxyphenyl)methyl]piperidine-3-carboxamide
CID 163313631
(2R)-2-hydroxy-N-methyl-N-[(4-phenoxyphenyl)methyl]propanamide
CID 70764862
(1R,2R,3R,4R)-3,4-bis[[4-(4-fluorophenoxy)phenyl]methyl-methylcarbamoyl]cyclobutane-1,2-dicarboxylic acid
CID 18663920
N-methyl-2-[(3R)-morpholin-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
CID 96572362
N-methyl-2-morpholin-2-yl-N-[(4-phenoxyphenyl)methyl]acetamide
CID 70776717

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide?
The IUPAC name of N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide (CID 131905559) is N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide.
What is the SMILES notation for N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide?
The canonical SMILES for N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide is CN(Cc1ccc(Oc2ccccc2)cc1)C(=O)C1CC(=O)OC12CCCC2.
What is the InChIKey of N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide?
The InChIKey is WKDNPCGDCDYHFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO4/c1-24(22(26)20-15-21(25)28-23(20)13-5-6-14-23)16-17-9-11-19(12-10-17)27-18-7-3-2-4-8-18/h2-4,7-12,20H,5-6,13-16H2,1H3.
What are the key properties of N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide?
N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide has a molecular weight of 379.46 g/mol, XLogP of 4.31, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-oxo-N-[(4-phenoxyphenyl)methyl]-1-oxaspiro[4.4]nonane-4-carboxamide is sourced from PubChem (CID 131905559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).