(2-amino-4-bromo-6-chlorophenyl) carbamate

C7H6BrClN2O2 — CID 131183552

IUPAC(2-amino-4-bromo-6-chlorophenyl) carbamate
SMILESNC(=O)Oc1c(N)cc(Br)cc1Cl
InChIInChI=1S/C7H6BrClN2O2/c8-3-1-4(9)6(5(10)2-3)13-7(11)12/h1-2H,10H2,(H2,11,12)
InChIKeyRZFYWJHIXYWXSS-UHFFFAOYSA-N
MW265.49 g/mol
LogP2.14
Rot. Bonds1

About (2-amino-4-bromo-6-chlorophenyl) carbamate

(2-amino-4-bromo-6-chlorophenyl) carbamate (PubChem CID 131183552) has the molecular formula C7H6BrClN2O2 and a molecular weight of 265.49 g/mol. Its IUPAC name is (2-amino-4-bromo-6-chlorophenyl) carbamate.

Molecular Properties

Compound Name(2-amino-4-bromo-6-chlorophenyl) carbamate
PubChem CID131183552
Molecular FormulaC7H6BrClN2O2
Molecular Weight265.49 g/mol
Exact Mass263.93
IUPAC Name(2-amino-4-bromo-6-chlorophenyl) carbamate
SMILESNC(=O)Oc1c(N)cc(Br)cc1Cl
InChIInChI=1S/C7H6BrClN2O2/c8-3-1-4(9)6(5(10)2-3)13-7(11)12/h1-2H,10H2,(H2,11,12)
InChIKeyRZFYWJHIXYWXSS-UHFFFAOYSA-N
XLogP2.14
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.49
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(4-bromo-2,6-dichlorophenyl) 2-chloroacetate
CID 87706469
(3,5-dibromophenyl) carbamate
CID 175177777
2-(2,4-dibromo-6-chlorophenoxy)acetamide
CID 91674426
1-(2-amino-4-bromo-6-chlorophenyl)-2-chloroethanone
CID 171011742
(4-bromo-2-chloro-6-methylphenyl) acetate
CID 130685721
2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide
CID 82920977
2-amino-5-bromo-3-chlorobenzoate
CID 6948109
(2,4-dibromo-6-chlorophenyl) pentanoate
CID 90878938
3-amino-2-(4-bromo-2-chlorophenoxy)benzamide
CID 112579736
(4-chloro-2-fluorothiophen-3-yl) carbamate
CID 175376629
(3-amino-5-chloro-2-fluorophenyl) carbamate
CID 174670432
(2-bromo-5-chlorophenyl) carbamate
CID 174508201

Frequently Asked Questions

What is the IUPAC name of (2-amino-4-bromo-6-chlorophenyl) carbamate?
The IUPAC name of (2-amino-4-bromo-6-chlorophenyl) carbamate (CID 131183552) is (2-amino-4-bromo-6-chlorophenyl) carbamate.
What is the SMILES notation for (2-amino-4-bromo-6-chlorophenyl) carbamate?
The canonical SMILES for (2-amino-4-bromo-6-chlorophenyl) carbamate is NC(=O)Oc1c(N)cc(Br)cc1Cl.
What is the InChIKey of (2-amino-4-bromo-6-chlorophenyl) carbamate?
The InChIKey is RZFYWJHIXYWXSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrClN2O2/c8-3-1-4(9)6(5(10)2-3)13-7(11)12/h1-2H,10H2,(H2,11,12).
What are the key properties of (2-amino-4-bromo-6-chlorophenyl) carbamate?
(2-amino-4-bromo-6-chlorophenyl) carbamate has a molecular weight of 265.49 g/mol, XLogP of 2.14, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-bromo-6-chlorophenyl) carbamate is sourced from PubChem (CID 131183552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).