4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine

C19H23NO — CID 15340757

IUPAC4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine
SMILESCC1CC(C)(C)N=C(C(C)c2cccc3ccccc23)O1
InChIInChI=1S/C19H23NO/c1-13-12-19(3,4)20-18(21-13)14(2)16-11-7-9-15-8-5-6-10-17(15)16/h5-11,13-14H,12H2,1-4H3
InChIKeyNDNAVLXTUYWXIG-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.93
Rot. Bonds2

About 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine

4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine (PubChem CID 15340757) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine.

Molecular Properties

Compound Name4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine
PubChem CID15340757
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine
SMILESCC1CC(C)(C)N=C(C(C)c2cccc3ccccc23)O1
InChIInChI=1S/C19H23NO/c1-13-12-19(3,4)20-18(21-13)14(2)16-11-7-9-15-8-5-6-10-17(15)16/h5-11,13-14H,12H2,1-4H3
InChIKeyNDNAVLXTUYWXIG-UHFFFAOYSA-N
XLogP4.93
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(Naphthalen-1-ylmethyl)-3-(2-phenylethyl)-4,5-dihydro-1,2-oxazole
CID 24881682
4H-1,3-Oxazine, 5,6-dihydro-2-(2-(1-naphthalenyl)ethenyl)-4,4,6-trimethyl-, hydrochloride, (E)-
CID 6447780
5-(Naphthalen-1-ylmethyl)-3-(2-phenylethyl)-4,5-dihydro-1,2-oxazole;hydrochloride
CID 44585993
Ethyl 2-(naphthalen-1-yl)ethanecarboximidate hydrochloride
CID 12317288
2-[(1S,2S)-2-benzyl-1-methyl-2H-naphthalen-1-yl]-4,4-dimethyl-5H-1,3-oxazole
CID 134999013
4,4,6-trimethyl-2-[(E)-2-naphthalen-1-ylethenyl]-5,6-dihydro-1,3-oxazine
CID 6447781
4,4,6-Trimethyl-2-(1-phenylhexyl)-5,6-dihydro-1,3-oxazine
CID 289255
2-(1,3-Diphenylpropan-2-yl)-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
CID 293645
4,4,6-Trimethyl-2-(1-phenylpent-4-en-2-yl)-5,6-dihydro-1,3-oxazine
CID 293646
2-(1-Benzylpropyl)-4,4,6-trimethyl-5,6-dihydro-4H-1,3-oxazine
CID 293650
4,4,6-Trimethyl-2-(1-phenylhex-5-en-2-yl)-5,6-dihydro-1,3-oxazine
CID 293655
2-Benzyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine;4,4,6-trimethyl-2-(1-phenylpropyl)-5,6-dihydro-1,3-oxazine
CID 293667

Frequently Asked Questions

What is the IUPAC name of 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine?
The IUPAC name of 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine (CID 15340757) is 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine.
What is the SMILES notation for 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine?
The canonical SMILES for 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine is CC1CC(C)(C)N=C(C(C)c2cccc3ccccc23)O1.
What is the InChIKey of 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine?
The InChIKey is NDNAVLXTUYWXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-13-12-19(3,4)20-18(21-13)14(2)16-11-7-9-15-8-5-6-10-17(15)16/h5-11,13-14H,12H2,1-4H3.
What are the key properties of 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine?
4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine has a molecular weight of 281.40 g/mol, XLogP of 4.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,6-trimethyl-2-(1-naphthalen-1-ylethyl)-5,6-dihydro-1,3-oxazine is sourced from PubChem (CID 15340757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).