2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide

C16H22N2O3 — CID 3043214

IUPAC2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide
SMILESCCCN(CCC)C(=O)N1CC(c2ccccc2)OC1=O
InChIInChI=1S/C16H22N2O3/c1-3-10-17(11-4-2)15(19)18-12-14(21-16(18)20)13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3
InChIKeyLYMMWHIAGMZYGZ-UHFFFAOYSA-N
MW290.36 g/mol
LogP3.42
Rot. Bonds5

About 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide

2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide (PubChem CID 3043214) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide
PubChem CID3043214
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide
SMILESCCCN(CCC)C(=O)N1CC(c2ccccc2)OC1=O
InChIInChI=1S/C16H22N2O3/c1-3-10-17(11-4-2)15(19)18-12-14(21-16(18)20)13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3
InChIKeyLYMMWHIAGMZYGZ-UHFFFAOYSA-N
XLogP3.42
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Mlv 6976
CID 65882
3,4-Dimethyl-5-Phenyl-1,3-Oxazolidin-2-One
CID 237192
Ephedroxane
CID 161171
Profexalone
CID 65786
(4R,5S)-3-[3-(Azepan-1-yl)propyl]-4-(2-methylpropyl)-5-phenyl-1,3-oxazolidin-2-one--hydrogen chloride (1/1)
CID 13713368
(4S,5S)-3,4-Dimethyl-5-phenyl-1,3-oxazolidin-2-one
CID 177727
US10343992, Example 264
CID 134363661
Mlv 3076
CID 128596
2-Oxazolidinone, 3-(3-(hexahydro-1H-azepin-1-yl)propyl)-4-(2-methylpropyl)-5-phenyl-, (4R-cis)-
CID 3064674
2-Oxazolidinone, 3-(3-(hexahydro-1H-azepin-1-yl)propyl)-4-(2-methylpropyl)-5-phenyl-, (4S-trans)-
CID 3064675
2-Oxazolidinone, 3-(3-(hexahydro-1H-azepin-1-yl)propyl)-4-(2-methylpropyl)-5-phenyl-, (4R-trans)-
CID 3064676
2-Oxazolidinone, 4-(2-methylpropyl)-5-phenyl-3-(3-(1-piperidinyl)propyl)-, (4R-cis)-
CID 13713344

Frequently Asked Questions

What is the IUPAC name of 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide?
The IUPAC name of 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide (CID 3043214) is 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide.
What is the SMILES notation for 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide?
The canonical SMILES for 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide is CCCN(CCC)C(=O)N1CC(c2ccccc2)OC1=O.
What is the InChIKey of 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide?
The InChIKey is LYMMWHIAGMZYGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-3-10-17(11-4-2)15(19)18-12-14(21-16(18)20)13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3.
What are the key properties of 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide?
2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 3.42, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-5-phenyl-N,N-dipropyl-1,3-oxazolidine-3-carboxamide is sourced from PubChem (CID 3043214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).