3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one

C9H13NO2 — CID 11263710

IUPAC3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one
SMILESCC1CC2=CCCCN2C(=O)O1
InChIInChI=1S/C9H13NO2/c1-7-6-8-4-2-3-5-10(8)9(11)12-7/h4,7H,2-3,5-6H2,1H3
InChIKeyGHEIWNSRLNRKTJ-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.89
Rot. Bonds

About 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one

3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one (PubChem CID 11263710) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one.

Molecular Properties

Compound Name3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one
PubChem CID11263710
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one
SMILESCC1CC2=CCCCN2C(=O)O1
InChIInChI=1S/C9H13NO2/c1-7-6-8-4-2-3-5-10(8)9(11)12-7/h4,7H,2-3,5-6H2,1H3
InChIKeyGHEIWNSRLNRKTJ-UHFFFAOYSA-N
XLogP1.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

ethyl 6-methyl-3,4-dihydro-2H-pyridine-1-carboxylate
CID 101149477
3-ethyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one
CID 12184796
3-propan-2-yl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one
CID 12184798
3-(2-methylpropyl)-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one
CID 12184799
(4E)-4-ethylidene-3-propan-2-yl-1,3-oxazinan-2-one
CID 132226547

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one?
The IUPAC name of 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one (CID 11263710) is 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one.
What is the SMILES notation for 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one?
The canonical SMILES for 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one is CC1CC2=CCCCN2C(=O)O1.
What is the InChIKey of 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one?
The InChIKey is GHEIWNSRLNRKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-7-6-8-4-2-3-5-10(8)9(11)12-7/h4,7H,2-3,5-6H2,1H3.
What are the key properties of 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one?
3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one has a molecular weight of 167.21 g/mol, XLogP of 1.89, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4,6,7,8-tetrahydro-3H-pyrido[1,2-c][1,3]oxazin-1-one is sourced from PubChem (CID 11263710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).