2-(tert-butylamino)phenol

C10H15NO — CID 70671108

IUPAC2-(tert-butylamino)phenol
SMILESCC(C)(C)Nc1ccccc1O
InChIInChI=1S/C10H15NO/c1-10(2,3)11-8-6-4-5-7-9(8)12/h4-7,11-12H,1-3H3
InChIKeyFOGHPNXRACBDCW-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.60
Rot. Bonds1

About 2-(tert-butylamino)phenol

2-(tert-butylamino)phenol (PubChem CID 70671108) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-(tert-butylamino)phenol.

Molecular Properties

Compound Name2-(tert-butylamino)phenol
PubChem CID70671108
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-(tert-butylamino)phenol
SMILESCC(C)(C)Nc1ccccc1O
InChIInChI=1S/C10H15NO/c1-10(2,3)11-8-6-4-5-7-9(8)12/h4-7,11-12H,1-3H3
InChIKeyFOGHPNXRACBDCW-UHFFFAOYSA-N
XLogP2.60
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)phenol?
The IUPAC name of 2-(tert-butylamino)phenol (CID 70671108) is 2-(tert-butylamino)phenol.
What is the SMILES notation for 2-(tert-butylamino)phenol?
The canonical SMILES for 2-(tert-butylamino)phenol is CC(C)(C)Nc1ccccc1O.
What is the InChIKey of 2-(tert-butylamino)phenol?
The InChIKey is FOGHPNXRACBDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-10(2,3)11-8-6-4-5-7-9(8)12/h4-7,11-12H,1-3H3.
What are the key properties of 2-(tert-butylamino)phenol?
2-(tert-butylamino)phenol has a molecular weight of 165.24 g/mol, XLogP of 2.60, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)phenol is sourced from PubChem (CID 70671108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).