(5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine

C9H15NO2 — CID 142287672

IUPAC(5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine
SMILESCOC1COC/C=C(C)\C=C/N1
InChIInChI=1S/C9H15NO2/c1-8-3-5-10-9(11-2)7-12-6-4-8/h3-5,9-10H,6-7H2,1-2H3/b5-3-,8-4-
InChIKeyDGKIWHUDHFETEV-ZWWVTPAXSA-N
MW169.22 g/mol
LogP1.04
Rot. Bonds1

About (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine

(5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine (PubChem CID 142287672) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine.

Molecular Properties

Compound Name(5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine
PubChem CID142287672
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name(5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine
SMILESCOC1COC/C=C(C)\C=C/N1
InChIInChI=1S/C9H15NO2/c1-8-3-5-10-9(11-2)7-12-6-4-8/h3-5,9-10H,6-7H2,1-2H3/b5-3-,8-4-
InChIKeyDGKIWHUDHFETEV-ZWWVTPAXSA-N
XLogP1.04
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine?
The IUPAC name of (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine (CID 142287672) is (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine.
What is the SMILES notation for (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine?
The canonical SMILES for (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine is COC1COC/C=C(C)\C=C/N1.
What is the InChIKey of (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine?
The InChIKey is DGKIWHUDHFETEV-ZWWVTPAXSA-N. The full InChI is InChI=1S/C9H15NO2/c1-8-3-5-10-9(11-2)7-12-6-4-8/h3-5,9-10H,6-7H2,1-2H3/b5-3-,8-4-.
What are the key properties of (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine?
(5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine has a molecular weight of 169.22 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,7Z)-3-methoxy-7-methyl-2,3,4,9-tetrahydro-1,4-oxazonine is sourced from PubChem (CID 142287672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).