4-(2-aminoethyl)-2-cyclohexylphenol

C14H21NO — CID 24748051

IUPAC4-(2-aminoethyl)-2-cyclohexylphenol
SMILESNCCc1ccc(O)c(C2CCCCC2)c1
InChIInChI=1S/C14H21NO/c15-9-8-11-6-7-14(16)13(10-11)12-4-2-1-3-5-12/h6-7,10,12,16H,1-5,8-9,15H2
InChIKeyDOCCSEDGBYCYLS-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.94
Rot. Bonds3

About 4-(2-aminoethyl)-2-cyclohexylphenol

4-(2-aminoethyl)-2-cyclohexylphenol (PubChem CID 24748051) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-(2-aminoethyl)-2-cyclohexylphenol.

Molecular Properties

Compound Name4-(2-aminoethyl)-2-cyclohexylphenol
PubChem CID24748051
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-(2-aminoethyl)-2-cyclohexylphenol
SMILESNCCc1ccc(O)c(C2CCCCC2)c1
InChIInChI=1S/C14H21NO/c15-9-8-11-6-7-14(16)13(10-11)12-4-2-1-3-5-12/h6-7,10,12,16H,1-5,8-9,15H2
InChIKeyDOCCSEDGBYCYLS-UHFFFAOYSA-N
XLogP2.94
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethyl)-2-cyclohexylphenol?
The IUPAC name of 4-(2-aminoethyl)-2-cyclohexylphenol (CID 24748051) is 4-(2-aminoethyl)-2-cyclohexylphenol.
What is the SMILES notation for 4-(2-aminoethyl)-2-cyclohexylphenol?
The canonical SMILES for 4-(2-aminoethyl)-2-cyclohexylphenol is NCCc1ccc(O)c(C2CCCCC2)c1.
What is the InChIKey of 4-(2-aminoethyl)-2-cyclohexylphenol?
The InChIKey is DOCCSEDGBYCYLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c15-9-8-11-6-7-14(16)13(10-11)12-4-2-1-3-5-12/h6-7,10,12,16H,1-5,8-9,15H2.
What are the key properties of 4-(2-aminoethyl)-2-cyclohexylphenol?
4-(2-aminoethyl)-2-cyclohexylphenol has a molecular weight of 219.33 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethyl)-2-cyclohexylphenol is sourced from PubChem (CID 24748051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).