2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine

C13H13Br2NS — CID 55096158

IUPAC2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine
SMILESCC(N)(Cc1ccc(Br)s1)c1ccccc1Br
InChIInChI=1S/C13H13Br2NS/c1-13(16,8-9-6-7-12(15)17-9)10-4-2-3-5-11(10)14/h2-7H,8,16H2,1H3
InChIKeyWQGIATOHLNOHCH-UHFFFAOYSA-N
MW375.13 g/mol
LogP4.69
Rot. Bonds3

About 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine

2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine (PubChem CID 55096158) has the molecular formula C13H13Br2NS and a molecular weight of 375.13 g/mol. Its IUPAC name is 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine.

Molecular Properties

Compound Name2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine
PubChem CID55096158
Molecular FormulaC13H13Br2NS
Molecular Weight375.13 g/mol
Exact Mass372.91
IUPAC Name2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine
SMILESCC(N)(Cc1ccc(Br)s1)c1ccccc1Br
InChIInChI=1S/C13H13Br2NS/c1-13(16,8-9-6-7-12(15)17-9)10-4-2-3-5-11(10)14/h2-7H,8,16H2,1H3
InChIKeyWQGIATOHLNOHCH-UHFFFAOYSA-N
XLogP4.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.13
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromophenyl)-1-(5-ethylthiophen-2-yl)propan-2-amine
CID 62620893
1-(5-bromothiophen-2-yl)-2-phenylpropan-2-amine
CID 62622178
1,2-bis(2-bromophenyl)propan-2-amine
CID 54919156
2-(3-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine
CID 62622744
1-(5-bromothiophen-2-yl)-2-(4-ethylphenyl)propan-2-amine
CID 62622583
3-[(5-bromothiophen-2-yl)methyl]pentan-3-amine
CID 62619965
1-(3-bromo-2,6-difluorophenyl)-2-(2-bromophenyl)propan-2-amine
CID 106265824
2-(2-bromophenyl)-1-(3-fluorophenyl)propan-2-amine
CID 60799082
1-(3-bromo-4-fluorophenyl)-2-(2-bromophenyl)propan-2-amine
CID 63408536
2-(2-bromophenyl)-1-(4-fluoro-2-methylphenyl)propan-2-amine
CID 114347080
2-(2-bromophenyl)-1-(2-chloro-3-fluorophenyl)propan-2-amine
CID 112653207
2-(2-bromophenyl)-1-(1-butan-2-ylpyrazol-3-yl)propan-2-amine
CID 64783132

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine?
The IUPAC name of 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine (CID 55096158) is 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine.
What is the SMILES notation for 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine?
The canonical SMILES for 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine is CC(N)(Cc1ccc(Br)s1)c1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine?
The InChIKey is WQGIATOHLNOHCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13Br2NS/c1-13(16,8-9-6-7-12(15)17-9)10-4-2-3-5-11(10)14/h2-7H,8,16H2,1H3.
What are the key properties of 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine?
2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine has a molecular weight of 375.13 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-1-(5-bromothiophen-2-yl)propan-2-amine is sourced from PubChem (CID 55096158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).