(4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine

C17H19NO — CID 135395681

IUPAC(4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine
SMILESc1ccc(C(C[C@H]2COCN2)c2ccccc2)cc1
InChIInChI=1S/C17H19NO/c1-3-7-14(8-4-1)17(11-16-12-19-13-18-16)15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-/m0/s1
InChIKeyZCGFQLAWFKUINY-INIZCTEOSA-N
MW253.35 g/mol
LogP3.15
Rot. Bonds4

About (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine

(4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine (PubChem CID 135395681) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine.

Molecular Properties

Compound Name(4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine
PubChem CID135395681
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name(4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine
SMILESc1ccc(C(C[C@H]2COCN2)c2ccccc2)cc1
InChIInChI=1S/C17H19NO/c1-3-7-14(8-4-1)17(11-16-12-19-13-18-16)15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-/m0/s1
InChIKeyZCGFQLAWFKUINY-INIZCTEOSA-N
XLogP3.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-benzyl-1,3-oxazolidine
CID 22719793
5-(2,2-diphenylethyl)-3,3-dimethylmorpholine
CID 10357167
(4S)-4-phenyl-1,3-oxazolidine
CID 54050063
(2-cyclopentyl-1-phenylethyl)benzene
CID 138978826
N-(3,3-diphenylpropyl)-2-[(3S)-morpholin-3-yl]acetamide
CID 95723724
1-(3-methylphenyl)-2-morpholin-3-ylethanamine
CID 116941527
2-morpholin-3-yl-1-naphthalen-2-ylethanamine
CID 116941547
2-hydroxy-N-(morpholin-3-ylmethyl)-2-phenylacetamide
CID 103548723
[4-(2,2-diphenylethyl)cyclohexyl]methanamine
CID 154511159
(4R)-4-(methylsulfanylmethyl)-1,3-oxazolidine
CID 150896334
N-(1-phenylpropyl)oxetan-3-amine
CID 63624948
3-(benzenesulfonylmethyl)morpholine
CID 117037196

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine?
The IUPAC name of (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine (CID 135395681) is (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine.
What is the SMILES notation for (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine?
The canonical SMILES for (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine is c1ccc(C(C[C@H]2COCN2)c2ccccc2)cc1.
What is the InChIKey of (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine?
The InChIKey is ZCGFQLAWFKUINY-INIZCTEOSA-N. The full InChI is InChI=1S/C17H19NO/c1-3-7-14(8-4-1)17(11-16-12-19-13-18-16)15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-/m0/s1.
What are the key properties of (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine?
(4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine has a molecular weight of 253.35 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(2,2-diphenylethyl)-1,3-oxazolidine is sourced from PubChem (CID 135395681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).