N,1-bis(2-bromophenyl)ethane-1,2-diamine

C14H14Br2N2 — CID 65384493

IUPACN,1-bis(2-bromophenyl)ethane-1,2-diamine
SMILESNCC(Nc1ccccc1Br)c1ccccc1Br
InChIInChI=1S/C14H14Br2N2/c15-11-6-2-1-5-10(11)14(9-17)18-13-8-4-3-7-12(13)16/h1-8,14,18H,9,17H2
InChIKeyYZMOAQVLHWXKEV-UHFFFAOYSA-N
MW370.09 g/mol
LogP4.32
Rot. Bonds4

About N,1-bis(2-bromophenyl)ethane-1,2-diamine

N,1-bis(2-bromophenyl)ethane-1,2-diamine (PubChem CID 65384493) has the molecular formula C14H14Br2N2 and a molecular weight of 370.09 g/mol. Its IUPAC name is N,1-bis(2-bromophenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN,1-bis(2-bromophenyl)ethane-1,2-diamine
PubChem CID65384493
Molecular FormulaC14H14Br2N2
Molecular Weight370.09 g/mol
Exact Mass367.95
IUPAC NameN,1-bis(2-bromophenyl)ethane-1,2-diamine
SMILESNCC(Nc1ccccc1Br)c1ccccc1Br
InChIInChI=1S/C14H14Br2N2/c15-11-6-2-1-5-10(11)14(9-17)18-13-8-4-3-7-12(13)16/h1-8,14,18H,9,17H2
InChIKeyYZMOAQVLHWXKEV-UHFFFAOYSA-N
XLogP4.32
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.09
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromophenyl)-1-(2-methylphenyl)ethane-1,2-diamine
CID 65383417
N-(2-bromophenyl)-1-(2-chlorophenyl)ethane-1,2-diamine
CID 65383000
1-(2-bromophenyl)-N-(2-chloro-5-fluorophenyl)ethane-1,2-diamine
CID 107527882
2-bromo-N-[1-(2-bromophenyl)ethyl]aniline
CID 43103209
N-(2-bromophenyl)-1-(4-ethoxyphenyl)ethane-1,2-diamine
CID 65384694
N-(2-bromophenyl)-1-thiophen-3-ylethane-1,2-diamine
CID 65384490
1-(3-bromo-4-fluorophenyl)-N-(2-bromophenyl)ethane-1,2-diamine
CID 65383419
N-(2-bromophenyl)-1-(3-tert-butyl-1-methylpyrazol-4-yl)ethane-1,2-diamine
CID 83090822
N-(2-bromophenyl)-1-[3-(trifluoromethyl)phenyl]ethane-1,2-diamine
CID 65383219
N,1-bis(2-chlorophenyl)ethane-1,2-diamine
CID 65377297
N-(2-bromophenyl)-1-(4-fluoro-3-methylphenyl)ethane-1,2-diamine
CID 65384259
2-(2-bromoanilino)-2-(2-bromophenyl)acetamide
CID 54892174

Frequently Asked Questions

What is the IUPAC name of N,1-bis(2-bromophenyl)ethane-1,2-diamine?
The IUPAC name of N,1-bis(2-bromophenyl)ethane-1,2-diamine (CID 65384493) is N,1-bis(2-bromophenyl)ethane-1,2-diamine.
What is the SMILES notation for N,1-bis(2-bromophenyl)ethane-1,2-diamine?
The canonical SMILES for N,1-bis(2-bromophenyl)ethane-1,2-diamine is NCC(Nc1ccccc1Br)c1ccccc1Br.
What is the InChIKey of N,1-bis(2-bromophenyl)ethane-1,2-diamine?
The InChIKey is YZMOAQVLHWXKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Br2N2/c15-11-6-2-1-5-10(11)14(9-17)18-13-8-4-3-7-12(13)16/h1-8,14,18H,9,17H2.
What are the key properties of N,1-bis(2-bromophenyl)ethane-1,2-diamine?
N,1-bis(2-bromophenyl)ethane-1,2-diamine has a molecular weight of 370.09 g/mol, XLogP of 4.32, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-bis(2-bromophenyl)ethane-1,2-diamine is sourced from PubChem (CID 65384493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).