nitrosocyclohexane

C6H11NO — CID 11768540

IUPACnitrosocyclohexane
SMILESO=NC1CCCCC1
InChIInChI=1S/C6H11NO/c8-7-6-4-2-1-3-5-6/h6H,1-5H2
InChIKeyAFLQDEOAJRGCOW-UHFFFAOYSA-N
MW113.16 g/mol
LogP2.09
Rot. Bonds1

About nitrosocyclohexane

nitrosocyclohexane (PubChem CID 11768540) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is nitrosocyclohexane.

Molecular Properties

Compound Namenitrosocyclohexane
PubChem CID11768540
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Namenitrosocyclohexane
SMILESO=NC1CCCCC1
InChIInChI=1S/C6H11NO/c8-7-6-4-2-1-3-5-6/h6H,1-5H2
InChIKeyAFLQDEOAJRGCOW-UHFFFAOYSA-N
XLogP2.09
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of nitrosocyclohexane?
The IUPAC name of nitrosocyclohexane (CID 11768540) is nitrosocyclohexane.
What is the SMILES notation for nitrosocyclohexane?
The canonical SMILES for nitrosocyclohexane is O=NC1CCCCC1.
What is the InChIKey of nitrosocyclohexane?
The InChIKey is AFLQDEOAJRGCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c8-7-6-4-2-1-3-5-6/h6H,1-5H2.
What are the key properties of nitrosocyclohexane?
nitrosocyclohexane has a molecular weight of 113.16 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for nitrosocyclohexane is sourced from PubChem (CID 11768540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).