(4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane

C17H19NO — CID 10083619

IUPAC(4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane
SMILESC[C@@H]1C[C@@H](c2ccccc2)OCN1c1ccccc1
InChIInChI=1S/C17H19NO/c1-14-12-17(15-8-4-2-5-9-15)19-13-18(14)16-10-6-3-7-11-16/h2-11,14,17H,12-13H2,1H3/t14-,17+/m1/s1
InChIKeyJYXOGFINRFKIKN-PBHICJAKSA-N
MW253.35 g/mol
LogP4.00
Rot. Bonds2

About (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane

(4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane (PubChem CID 10083619) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane.

Molecular Properties

Compound Name(4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane
PubChem CID10083619
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name(4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane
SMILESC[C@@H]1C[C@@H](c2ccccc2)OCN1c1ccccc1
InChIInChI=1S/C17H19NO/c1-14-12-17(15-8-4-2-5-9-15)19-13-18(14)16-10-6-3-7-11-16/h2-11,14,17H,12-13H2,1H3/t14-,17+/m1/s1
InChIKeyJYXOGFINRFKIKN-PBHICJAKSA-N
XLogP4.00
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 102496520
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CID 95566552
3-phenyl-1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazin-6-ol
CID 4033121
ethane;2-phenyloxirane
CID 54171856
2-phenyloxirane
CID 7276
1-ethyl-5-methyl-3,4-diphenylimidazolidine
CID 14143406
3,6-bis(4-chlorophenyl)-4-pyridin-3-yl-1,3-oxazinane
CID 51357605
(4S,5R)-1,3,4,5-tetraphenylimidazolidine
CID 15727757
(2R,6S)-2,4,6-triphenylmorpholine
CID 102292623
(3S,5R)-5-phenyloxolan-3-ol
CID 97052112
(2S,4S)-2-methyl-4-phenyl-1,3-dioxolane
CID 10374766
3,5-diphenyl-1,3-oxazolidin-2-one
CID 568810

Frequently Asked Questions

What is the IUPAC name of (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane?
The IUPAC name of (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane (CID 10083619) is (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane.
What is the SMILES notation for (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane?
The canonical SMILES for (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane is C[C@@H]1C[C@@H](c2ccccc2)OCN1c1ccccc1.
What is the InChIKey of (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane?
The InChIKey is JYXOGFINRFKIKN-PBHICJAKSA-N. The full InChI is InChI=1S/C17H19NO/c1-14-12-17(15-8-4-2-5-9-15)19-13-18(14)16-10-6-3-7-11-16/h2-11,14,17H,12-13H2,1H3/t14-,17+/m1/s1.
What are the key properties of (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane?
(4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane has a molecular weight of 253.35 g/mol, XLogP of 4.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,6S)-4-methyl-3,6-diphenyl-1,3-oxazinane is sourced from PubChem (CID 10083619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).