6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine

C9H17NO — CID 170792765

IUPAC6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine
SMILESCCC1=C(C(C)C)NCCO1
InChIInChI=1S/C9H17NO/c1-4-8-9(7(2)3)10-5-6-11-8/h7,10H,4-6H2,1-3H3
InChIKeyGZBZEZANOTXJCV-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.88
Rot. Bonds2

About 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine

6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine (PubChem CID 170792765) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine.

Molecular Properties

Compound Name6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine
PubChem CID170792765
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine
SMILESCCC1=C(C(C)C)NCCO1
InChIInChI=1S/C9H17NO/c1-4-8-9(7(2)3)10-5-6-11-8/h7,10H,4-6H2,1-3H3
InChIKeyGZBZEZANOTXJCV-UHFFFAOYSA-N
XLogP1.88
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methane;2-methylpropane;1,3-oxazolidine-2-thione
CID 158615181
8-ethyl-7-propan-2-yl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine
CID 146488534
(2Z)-2,3-diethyl-1,4,7,10-tetraoxacyclododec-2-ene
CID 118400698
2-methylpropane;1,3-oxazolidin-2-one
CID 143049841
2-methoxypropane;1,3-oxazolidin-2-one
CID 177227650
ethane;2-methoxypropane;1,3-oxazolidin-2-one
CID 177227287
2-(2-methylpropylidene)-1,3-oxazolidine
CID 174399163
8-ethyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine
CID 145305840
1,3-oxazolidin-2-one;propan-1-ol
CID 144673356
ethane;8-methyl-7-propan-2-yl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine
CID 153397819
2-propan-2-yl-1,5,6,7-tetrahydroimidazo[4,5-b][1,4]oxazine
CID 122697218
7-butan-2-yl-6-methoxy-3,4-dihydro-2H-1,4-benzoxazine
CID 177025565

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine?
The IUPAC name of 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine (CID 170792765) is 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine.
What is the SMILES notation for 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine?
The canonical SMILES for 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine is CCC1=C(C(C)C)NCCO1.
What is the InChIKey of 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine?
The InChIKey is GZBZEZANOTXJCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-4-8-9(7(2)3)10-5-6-11-8/h7,10H,4-6H2,1-3H3.
What are the key properties of 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine?
6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine has a molecular weight of 155.24 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-propan-2-yl-3,4-dihydro-2H-1,4-oxazine is sourced from PubChem (CID 170792765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).