(2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane

C11H25NO2 — CID 143101250

IUPAC(2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane
SMILESCC.CC.C[C@H]1C[C@@H](C)O[C@@H](N=O)C1
InChIInChI=1S/C7H13NO2.2C2H6/c1-5-3-6(2)10-7(4-5)8-9;2*1-2/h5-7H,3-4H2,1-2H3;2*1-2H3/t5-,6+,7+;;/m0../s1
InChIKeyGFXRWDDIKJHYHS-OJSHLMAWSA-N
MW203.33 g/mol
LogP3.97
Rot. Bonds1

About (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane

(2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane (PubChem CID 143101250) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane.

Molecular Properties

Compound Name(2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane
PubChem CID143101250
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name(2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane
SMILESCC.CC.C[C@H]1C[C@@H](C)O[C@@H](N=O)C1
InChIInChI=1S/C7H13NO2.2C2H6/c1-5-3-6(2)10-7(4-5)8-9;2*1-2/h5-7H,3-4H2,1-2H3;2*1-2H3/t5-,6+,7+;;/m0../s1
InChIKeyGFXRWDDIKJHYHS-OJSHLMAWSA-N
XLogP3.97
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane 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

1-methyl-3-nitrosocyclobutane
CID 90685254
(2R)-4,6-dimethyloxan-2-ol
CID 142116366
2,4-dimethyl-6-propan-2-yloxane
CID 86234215
O-[(2S,4S,6R)-4,6-dimethyloxan-2-yl]hydroxylamine
CID 143101362
[(4S)-4,6-dimethyloxan-2-yl]methanol
CID 59821303
(5R)-3-methyl-7-nitrosobicyclo[3.3.1]nonane
CID 123586530
2-[(2S,4S,6S)-4,6-dimethyloxan-2-yl]ethanamine
CID 59821310
(5S)-3-methyl-6-oxabicyclo[3.1.1]heptane
CID 154522264
(2S,6R)-2-[2-[(2R,4S,6S)-4,6-dimethyloxan-2-yl]ethyl]-4-iodo-6-methyloxane
CID 155451124
2,4-dimethyloxane;ethane
CID 143101228
(1S,5R)-3-methyl-8-oxabicyclo[3.2.1]octane
CID 155450472
(2R,6R)-4-bromo-2,6-dimethyloxane
CID 96839693

Frequently Asked Questions

What is the IUPAC name of (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane?
The IUPAC name of (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane (CID 143101250) is (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane.
What is the SMILES notation for (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane?
The canonical SMILES for (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane is CC.CC.C[C@H]1C[C@@H](C)O[C@@H](N=O)C1.
What is the InChIKey of (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane?
The InChIKey is GFXRWDDIKJHYHS-OJSHLMAWSA-N. The full InChI is InChI=1S/C7H13NO2.2C2H6/c1-5-3-6(2)10-7(4-5)8-9;2*1-2/h5-7H,3-4H2,1-2H3;2*1-2H3/t5-,6+,7+;;/m0../s1.
What are the key properties of (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane?
(2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane has a molecular weight of 203.33 g/mol, XLogP of 3.97, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S,6R)-2,4-dimethyl-6-nitrosooxane;ethane is sourced from PubChem (CID 143101250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).