5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol

C8H11NO2 — CID 163540965

IUPAC5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol
SMILESCC1=C2NCCOC2=C(O)C1
InChIInChI=1S/C8H11NO2/c1-5-4-6(10)8-7(5)9-2-3-11-8/h9-10H,2-4H2,1H3
InChIKeyFBBCTOQEVBJUCW-UHFFFAOYSA-N
MW153.18 g/mol
LogP1.05
Rot. Bonds

About 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol

5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol (PubChem CID 163540965) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol.

Molecular Properties

Compound Name5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol
PubChem CID163540965
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol
SMILESCC1=C2NCCOC2=C(O)C1
InChIInChI=1S/C8H11NO2/c1-5-4-6(10)8-7(5)9-2-3-11-8/h9-10H,2-4H2,1H3
InChIKeyFBBCTOQEVBJUCW-UHFFFAOYSA-N
XLogP1.05
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol 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

acetyl chloride;1,3-oxazolidin-2-one
CID 22468284
2-methylpropane;1,3-oxazolidin-2-one
CID 143049841
1,3-oxazolidin-2-one;hydrate
CID 141149411
1,3-oxazolidin-2-one;stannane
CID 173239925
1,3-oxazolidin-2-one;propan-1-ol
CID 144673356
5-methyl-3,4-dihydro-2H-1,4-oxazepin-7-one
CID 55288246
bis(1,3-oxazolidin-2-one);piperazine
CID 66663438
6,7-dimethyl-2,3,4,5-tetrahydro-1,4-oxazepine
CID 90942786
7,8-dimethyl-3,4-dihydro-2H-1,4-benzoxazepin-5-one
CID 59548550
6,7-dimethyl-3,4-dihydro-2H-1,4-benzoxazine
CID 20571249
2-methoxypropane;1,3-oxazolidin-2-one
CID 177227650
methane;2-methylpropane;1,3-oxazolidine-2-thione
CID 158615181

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol?
The IUPAC name of 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol (CID 163540965) is 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol.
What is the SMILES notation for 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol?
The canonical SMILES for 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol is CC1=C2NCCOC2=C(O)C1.
What is the InChIKey of 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol?
The InChIKey is FBBCTOQEVBJUCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-5-4-6(10)8-7(5)9-2-3-11-8/h9-10H,2-4H2,1H3.
What are the key properties of 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol?
5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol has a molecular weight of 153.18 g/mol, XLogP of 1.05, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,3,4,6-tetrahydrocyclopenta[b][1,4]oxazin-7-ol is sourced from PubChem (CID 163540965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).