4-(6-nitrosohexyl)cyclohexan-1-ol

C12H23NO2 — CID 89212153

IUPAC4-(6-nitrosohexyl)cyclohexan-1-ol
SMILESO=NCCCCCCC1CCC(O)CC1
InChIInChI=1S/C12H23NO2/c14-12-8-6-11(7-9-12)5-3-1-2-4-10-13-15/h11-12,14H,1-10H2
InChIKeyIMVNRORRIUCGLC-UHFFFAOYSA-N
MW213.32 g/mol
LogP3.25
Rot. Bonds7

About 4-(6-nitrosohexyl)cyclohexan-1-ol

4-(6-nitrosohexyl)cyclohexan-1-ol (PubChem CID 89212153) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-(6-nitrosohexyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(6-nitrosohexyl)cyclohexan-1-ol
PubChem CID89212153
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name4-(6-nitrosohexyl)cyclohexan-1-ol
SMILESO=NCCCCCCC1CCC(O)CC1
InChIInChI=1S/C12H23NO2/c14-12-8-6-11(7-9-12)5-3-1-2-4-10-13-15/h11-12,14H,1-10H2
InChIKeyIMVNRORRIUCGLC-UHFFFAOYSA-N
XLogP3.25
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-3-(4-nitrosobutyl)cyclobutane
CID 155446130
2-nitrosoethylcyclooctane
CID 129141307
2-nitrosoethylcyclotridecane
CID 138619052
4-[5-(4-hydroxycyclohexyl)pentyl]phenol
CID 15052392
3-tridecylcyclopentan-1-ol
CID 67606099
1-ethyl-2-[2-(5-nitrosopentyl)cyclobutyl]cyclobutane
CID 90139041
bis[2-(4-hydroxycyclohexyl)ethyl] carbonate
CID 140760910
5-cyclobutylpentylcyclobutane
CID 173228999
1-[4-amino-8-(4-hydroxycyclohexyl)octan-2-yl]pyrrolidine-2,5-dione
CID 170388734
1,4-dihexylcyclohexane
CID 22947938
1-dodecyl-4-pentadecylcyclohexane
CID 123560684
octadecane;pentadecylcyclopropane
CID 173301851

Frequently Asked Questions

What is the IUPAC name of 4-(6-nitrosohexyl)cyclohexan-1-ol?
The IUPAC name of 4-(6-nitrosohexyl)cyclohexan-1-ol (CID 89212153) is 4-(6-nitrosohexyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(6-nitrosohexyl)cyclohexan-1-ol?
The canonical SMILES for 4-(6-nitrosohexyl)cyclohexan-1-ol is O=NCCCCCCC1CCC(O)CC1.
What is the InChIKey of 4-(6-nitrosohexyl)cyclohexan-1-ol?
The InChIKey is IMVNRORRIUCGLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c14-12-8-6-11(7-9-12)5-3-1-2-4-10-13-15/h11-12,14H,1-10H2.
What are the key properties of 4-(6-nitrosohexyl)cyclohexan-1-ol?
4-(6-nitrosohexyl)cyclohexan-1-ol has a molecular weight of 213.32 g/mol, XLogP of 3.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-nitrosohexyl)cyclohexan-1-ol is sourced from PubChem (CID 89212153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).