5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol

C11H21NO3 — CID 123930678

IUPAC5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol
SMILESCOC1(C(C)C)CCC(C)(N=O)C(O)C1
InChIInChI=1S/C11H21NO3/c1-8(2)11(15-4)6-5-10(3,12-14)9(13)7-11/h8-9,13H,5-7H2,1-4H3
InChIKeyFUUJBIQPVHAAPQ-UHFFFAOYSA-N
MW215.29 g/mol
LogP2.10
Rot. Bonds3

About 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol

5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol (PubChem CID 123930678) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol
PubChem CID123930678
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol
SMILESCOC1(C(C)C)CCC(C)(N=O)C(O)C1
InChIInChI=1S/C11H21NO3/c1-8(2)11(15-4)6-5-10(3,12-14)9(13)7-11/h8-9,13H,5-7H2,1-4H3
InChIKeyFUUJBIQPVHAAPQ-UHFFFAOYSA-N
XLogP2.10
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 88564364
1-(1-methoxy-4,4-dimethylcyclohexyl)-2-methylpropan-1-ol
CID 116755601
1-methyl-2-nitroso-4-propan-2-ylcyclohexane-1,4-diol
CID 123724975
cyclopropyl-(1-methoxy-4,4-dimethylcyclohexyl)methanol
CID 116755683
4-methoxy-4-propan-2-ylpiperidine;hydrochloride
CID 68569417
4-ethylsulfonyl-1-(1-methoxy-4,4-dimethylcyclohexyl)butan-1-amine
CID 116769078
(1-propan-2-ylcyclopentyl) acetate
CID 58143154
1-(4-methoxyoxan-4-yl)ethanol
CID 116753835
1,4-di(propan-2-yl)bicyclo[2.2.2]octan-2-ol
CID 138736701
1-[(1S)-2,2-dimethylcyclopropyl]-2-methylpropan-1-one
CID 90129359
1-methoxy-4-methylbicyclo[2.2.2]oct-5-en-2-ol
CID 130128743
1-(1-methoxy-4-methylcyclohexyl)hexan-1-ol
CID 116754485

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol (CID 123930678) is 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol is COC1(C(C)C)CCC(C)(N=O)C(O)C1.
What is the InChIKey of 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol?
The InChIKey is FUUJBIQPVHAAPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-8(2)11(15-4)6-5-10(3,12-14)9(13)7-11/h8-9,13H,5-7H2,1-4H3.
What are the key properties of 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol?
5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol has a molecular weight of 215.29 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-methyl-2-nitroso-5-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 123930678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).