4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one

C25H25NO4 — CID 134346351

IUPAC4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc(CCCC(=O)N2C(=O)OCC2Cc2ccccc2)c2ccccc12
InChIInChI=1S/C25H25NO4/c1-29-23-15-14-19(21-11-5-6-12-22(21)23)10-7-13-24(27)26-20(17-30-25(26)28)16-18-8-3-2-4-9-18/h2-6,8-9,11-12,14-15,20H,7,10,13,16-17H2,1H3
InChIKeyFGGZHVBBDBCHRB-UHFFFAOYSA-N
MW403.48 g/mol
LogP4.76
Rot. Bonds7

About 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one

4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one (PubChem CID 134346351) has the molecular formula C25H25NO4 and a molecular weight of 403.48 g/mol. Its IUPAC name is 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one
PubChem CID134346351
Molecular FormulaC25H25NO4
Molecular Weight403.48 g/mol
Exact Mass403.18
IUPAC Name4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc(CCCC(=O)N2C(=O)OCC2Cc2ccccc2)c2ccccc12
InChIInChI=1S/C25H25NO4/c1-29-23-15-14-19(21-11-5-6-12-22(21)23)10-7-13-24(27)26-20(17-30-25(26)28)16-18-8-3-2-4-9-18/h2-6,8-9,11-12,14-15,20H,7,10,13,16-17H2,1H3
InChIKeyFGGZHVBBDBCHRB-UHFFFAOYSA-N
XLogP4.76
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one 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

(4S)-4-benzyl-3-(4-phenylbutanoyl)-1,3-oxazolidin-2-one
CID 10592004
1,6-bis[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]hexane-1,6-dione
CID 92642348
(4S)-3-[(2S)-2-azido-4-(4-methoxynaphthalen-1-yl)butanoyl]-4-benzyl-1,3-oxazolidin-2-one
CID 90223760
(4R)-4-benzyl-3-(6-phenylhexanoyl)-1,3-oxazolidin-2-one
CID 70251380
4-benzyl-3-[2-(4-methoxy-3-methylphenyl)acetyl]-1,3-oxazolidin-2-one
CID 69145722
(4R)-4-benzyl-3-undecanoyl-1,3-oxazolidin-2-one
CID 71349223
(4R)-4-benzyl-3-octanoyl-1,3-oxazolidin-2-one
CID 10286343
4-benzyl-3-(2-phenylacetyl)-1,3-oxazolidin-2-one
CID 15597771
(4S)-4-benzyl-3-(2-phenylacetyl)-1,3-oxazolidin-2-one
CID 11130206
(4S)-4-benzyl-3-[2-(4-methoxy-3-phenylmethoxyphenyl)acetyl]-1,3-oxazolidin-2-one
CID 15180731
1-[(4S)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]hexane-1,4-dione
CID 176582828
(4S)-3-(3-azulen-1-ylpropanoyl)-4-benzyl-1,3-oxazolidin-2-one
CID 15432210

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one?
The IUPAC name of 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one (CID 134346351) is 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one is COc1ccc(CCCC(=O)N2C(=O)OCC2Cc2ccccc2)c2ccccc12.
What is the InChIKey of 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one?
The InChIKey is FGGZHVBBDBCHRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25NO4/c1-29-23-15-14-19(21-11-5-6-12-22(21)23)10-7-13-24(27)26-20(17-30-25(26)28)16-18-8-3-2-4-9-18/h2-6,8-9,11-12,14-15,20H,7,10,13,16-17H2,1H3.
What are the key properties of 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one?
4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one has a molecular weight of 403.48 g/mol, XLogP of 4.76, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-3-[4-(4-methoxynaphthalen-1-yl)butanoyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 134346351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).