2,6-dichloro-4-(cyclobutylamino)phenol

C10H11Cl2NO — CID 107679292

IUPAC2,6-dichloro-4-(cyclobutylamino)phenol
SMILESOc1c(Cl)cc(NC2CCC2)cc1Cl
InChIInChI=1S/C10H11Cl2NO/c11-8-4-7(5-9(12)10(8)14)13-6-2-1-3-6/h4-6,13-14H,1-3H2
InChIKeyRAFYZHZOZDETQX-UHFFFAOYSA-N
MW232.11 g/mol
LogP3.66
Rot. Bonds2

About 2,6-dichloro-4-(cyclobutylamino)phenol

2,6-dichloro-4-(cyclobutylamino)phenol (PubChem CID 107679292) has the molecular formula C10H11Cl2NO and a molecular weight of 232.11 g/mol. Its IUPAC name is 2,6-dichloro-4-(cyclobutylamino)phenol.

Molecular Properties

Compound Name2,6-dichloro-4-(cyclobutylamino)phenol
PubChem CID107679292
Molecular FormulaC10H11Cl2NO
Molecular Weight232.11 g/mol
Exact Mass231.02
IUPAC Name2,6-dichloro-4-(cyclobutylamino)phenol
SMILESOc1c(Cl)cc(NC2CCC2)cc1Cl
InChIInChI=1S/C10H11Cl2NO/c11-8-4-7(5-9(12)10(8)14)13-6-2-1-3-6/h4-6,13-14H,1-3H2
InChIKeyRAFYZHZOZDETQX-UHFFFAOYSA-N
XLogP3.66
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.11
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,6-dichloro-4-(spiro[4.5]decan-8-ylamino)phenol
CID 107679413
2,6-dichloro-4-[(4-propan-2-ylcyclohexyl)amino]phenol
CID 107679381
2,6-dichloro-4-(thiolan-3-ylamino)phenol
CID 107678926
2,6-dichloro-4-[(1-cyclopropyl-5-methylpyrrolidin-3-yl)amino]phenol
CID 107679322
2,6-dichloro-4-[(5-methylthiolan-3-yl)amino]phenol
CID 107678851
N-(3,5-dichloro-4-fluorophenyl)-4-methylcycloheptan-1-amine
CID 107572556
2,6-dichloro-4-[(2-methyloxolan-3-yl)amino]phenol
CID 107679147
2,4,6-trichloro-N-cyclobutylaniline
CID 63425611
3-chloro-N-cyclopentyl-4-fluoroaniline
CID 28938400
4-(3,5-dichloro-4-fluoroanilino)cyclohexan-1-ol
CID 107572751
N-(3,5-dichloro-4-fluorophenyl)azepan-4-amine
CID 107572825
N-(3,4-dichlorophenyl)-4-methylcycloheptan-1-amine
CID 65080891

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-4-(cyclobutylamino)phenol?
The IUPAC name of 2,6-dichloro-4-(cyclobutylamino)phenol (CID 107679292) is 2,6-dichloro-4-(cyclobutylamino)phenol.
What is the SMILES notation for 2,6-dichloro-4-(cyclobutylamino)phenol?
The canonical SMILES for 2,6-dichloro-4-(cyclobutylamino)phenol is Oc1c(Cl)cc(NC2CCC2)cc1Cl.
What is the InChIKey of 2,6-dichloro-4-(cyclobutylamino)phenol?
The InChIKey is RAFYZHZOZDETQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2NO/c11-8-4-7(5-9(12)10(8)14)13-6-2-1-3-6/h4-6,13-14H,1-3H2.
What are the key properties of 2,6-dichloro-4-(cyclobutylamino)phenol?
2,6-dichloro-4-(cyclobutylamino)phenol has a molecular weight of 232.11 g/mol, XLogP of 3.66, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-4-(cyclobutylamino)phenol is sourced from PubChem (CID 107679292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).