2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol

C15H23NO — CID 43741722

IUPAC2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol
SMILESCc1ccc(NC2CCCCC2C)c(C)c1O
InChIInChI=1S/C15H23NO/c1-10-6-4-5-7-13(10)16-14-9-8-11(2)15(17)12(14)3/h8-10,13,16-17H,4-7H2,1-3H3
InChIKeyUUZWPPIOTXSGPH-UHFFFAOYSA-N
MW233.35 g/mol
LogP4.00
Rot. Bonds2

About 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol

2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol (PubChem CID 43741722) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol.

Molecular Properties

Compound Name2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol
PubChem CID43741722
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol
SMILESCc1ccc(NC2CCCCC2C)c(C)c1O
InChIInChI=1S/C15H23NO/c1-10-6-4-5-7-13(10)16-14-9-8-11(2)15(17)12(14)3/h8-10,13,16-17H,4-7H2,1-3H3
InChIKeyUUZWPPIOTXSGPH-UHFFFAOYSA-N
XLogP4.00
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol?
The IUPAC name of 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol (CID 43741722) is 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol.
What is the SMILES notation for 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol?
The canonical SMILES for 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol is Cc1ccc(NC2CCCCC2C)c(C)c1O.
What is the InChIKey of 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol?
The InChIKey is UUZWPPIOTXSGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-10-6-4-5-7-13(10)16-14-9-8-11(2)15(17)12(14)3/h8-10,13,16-17H,4-7H2,1-3H3.
What are the key properties of 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol?
2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol has a molecular weight of 233.35 g/mol, XLogP of 4.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-3-[(2-methylcyclohexyl)amino]phenol is sourced from PubChem (CID 43741722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).