cyclohexanamine;phenol

C12H19NO — CID 18006893

IUPACcyclohexanamine;phenol
SMILESNC1CCCCC1.Oc1ccccc1
InChIInChI=1S/C6H13N.C6H6O/c2*7-6-4-2-1-3-5-6/h6H,1-5,7H2;1-5,7H
InChIKeyYINPYIQUHJQWLJ-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.67
Rot. Bonds

About cyclohexanamine;phenol

cyclohexanamine;phenol (PubChem CID 18006893) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is cyclohexanamine;phenol.

Molecular Properties

Compound Namecyclohexanamine;phenol
PubChem CID18006893
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Namecyclohexanamine;phenol
SMILESNC1CCCCC1.Oc1ccccc1
InChIInChI=1S/C6H13N.C6H6O/c2*7-6-4-2-1-3-5-6/h6H,1-5,7H2;1-5,7H
InChIKeyYINPYIQUHJQWLJ-UHFFFAOYSA-N
XLogP2.67
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclohexanamine;phenol?
The IUPAC name of cyclohexanamine;phenol (CID 18006893) is cyclohexanamine;phenol.
What is the SMILES notation for cyclohexanamine;phenol?
The canonical SMILES for cyclohexanamine;phenol is NC1CCCCC1.Oc1ccccc1.
What is the InChIKey of cyclohexanamine;phenol?
The InChIKey is YINPYIQUHJQWLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.C6H6O/c2*7-6-4-2-1-3-5-6/h6H,1-5,7H2;1-5,7H.
What are the key properties of cyclohexanamine;phenol?
cyclohexanamine;phenol has a molecular weight of 193.29 g/mol, XLogP of 2.67, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexanamine;phenol is sourced from PubChem (CID 18006893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).