3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide

C17H24N2O4 — CID 87028268

IUPAC3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide
SMILESCC(C)COCCC(=O)Nc1ccc(CN2CCOC2=O)cc1
InChIInChI=1S/C17H24N2O4/c1-13(2)12-22-9-7-16(20)18-15-5-3-14(4-6-15)11-19-8-10-23-17(19)21/h3-6,13H,7-12H2,1-2H3,(H,18,20)
InChIKeyIVIRFSJUKZXUTG-UHFFFAOYSA-N
MW320.39 g/mol
LogP2.64
Rot. Bonds8

About 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide

3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide (PubChem CID 87028268) has the molecular formula C17H24N2O4 and a molecular weight of 320.39 g/mol. Its IUPAC name is 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide.

Molecular Properties

Compound Name3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide
PubChem CID87028268
Molecular FormulaC17H24N2O4
Molecular Weight320.39 g/mol
Exact Mass320.17
IUPAC Name3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide
SMILESCC(C)COCCC(=O)Nc1ccc(CN2CCOC2=O)cc1
InChIInChI=1S/C17H24N2O4/c1-13(2)12-22-9-7-16(20)18-15-5-3-14(4-6-15)11-19-8-10-23-17(19)21/h3-6,13H,7-12H2,1-2H3,(H,18,20)
InChIKeyIVIRFSJUKZXUTG-UHFFFAOYSA-N
XLogP2.64
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-3-(2-methylpropoxy)propanamide
CID 55778329
N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-3-(2H-triazol-4-yl)propanamide
CID 126839263
3-(2-methylpropoxy)-N-(4-piperidin-1-ylsulfonylphenyl)propanamide
CID 55688252
methyl 4-[3-(2-methylpropoxy)propanoylamino]benzoate
CID 38953143
N-[4-(2-chloroethoxy)phenyl]-3-(2-methylpropoxy)propanamide
CID 139895476
5-hydroxy-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-2-propylpentanamide
CID 126839318
N-(4-acetylphenyl)-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide
CID 47378519
1-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-3-(5-propan-2-yl-1H-pyrazol-3-yl)urea
CID 126791783
N-(4-bromophenyl)-3-(2-oxo-1,3-oxazolidin-3-yl)propanamide
CID 47378353
1-(2,4-dichlorophenyl)-3-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]urea
CID 78895981
1-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethyl]-3-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]urea
CID 47051060
1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide?
The IUPAC name of 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide (CID 87028268) is 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide.
What is the SMILES notation for 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide?
The canonical SMILES for 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide is CC(C)COCCC(=O)Nc1ccc(CN2CCOC2=O)cc1.
What is the InChIKey of 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide?
The InChIKey is IVIRFSJUKZXUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O4/c1-13(2)12-22-9-7-16(20)18-15-5-3-14(4-6-15)11-19-8-10-23-17(19)21/h3-6,13H,7-12H2,1-2H3,(H,18,20).
What are the key properties of 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide?
3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide has a molecular weight of 320.39 g/mol, XLogP of 2.64, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropoxy)-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]propanamide is sourced from PubChem (CID 87028268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).