4-nitrosocyclohexan-1-ol

C6H11NO2 — CID 145304259

IUPAC4-nitrosocyclohexan-1-ol
SMILESO=NC1CCC(O)CC1
InChIInChI=1S/C6H11NO2/c8-6-3-1-5(7-9)2-4-6/h5-6,8H,1-4H2
InChIKeyRJQRAQUUKXSJCG-UHFFFAOYSA-N
MW129.16 g/mol
LogP1.06
Rot. Bonds1

About 4-nitrosocyclohexan-1-ol

4-nitrosocyclohexan-1-ol (PubChem CID 145304259) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 4-nitrosocyclohexan-1-ol.

Molecular Properties

Compound Name4-nitrosocyclohexan-1-ol
PubChem CID145304259
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name4-nitrosocyclohexan-1-ol
SMILESO=NC1CCC(O)CC1
InChIInChI=1S/C6H11NO2/c8-6-3-1-5(7-9)2-4-6/h5-6,8H,1-4H2
InChIKeyRJQRAQUUKXSJCG-UHFFFAOYSA-N
XLogP1.06
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-nitrosocyclohexan-1-ol?
The IUPAC name of 4-nitrosocyclohexan-1-ol (CID 145304259) is 4-nitrosocyclohexan-1-ol.
What is the SMILES notation for 4-nitrosocyclohexan-1-ol?
The canonical SMILES for 4-nitrosocyclohexan-1-ol is O=NC1CCC(O)CC1.
What is the InChIKey of 4-nitrosocyclohexan-1-ol?
The InChIKey is RJQRAQUUKXSJCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c8-6-3-1-5(7-9)2-4-6/h5-6,8H,1-4H2.
What are the key properties of 4-nitrosocyclohexan-1-ol?
4-nitrosocyclohexan-1-ol has a molecular weight of 129.16 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-nitrosocyclohexan-1-ol is sourced from PubChem (CID 145304259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).