2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine

C15H18BrN3 — CID 115147784

IUPAC2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine
SMILESCc1nc(N(C)CCc2ccccc2Br)ccc1N
InChIInChI=1S/C15H18BrN3/c1-11-14(17)7-8-15(18-11)19(2)10-9-12-5-3-4-6-13(12)16/h3-8H,9-10,17H2,1-2H3
InChIKeyRRKDPKWOGHCWSG-UHFFFAOYSA-N
MW320.23 g/mol
LogP3.41
Rot. Bonds4

About 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine

2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine (PubChem CID 115147784) has the molecular formula C15H18BrN3 and a molecular weight of 320.23 g/mol. Its IUPAC name is 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine
PubChem CID115147784
Molecular FormulaC15H18BrN3
Molecular Weight320.23 g/mol
Exact Mass319.07
IUPAC Name2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine
SMILESCc1nc(N(C)CCc2ccccc2Br)ccc1N
InChIInChI=1S/C15H18BrN3/c1-11-14(17)7-8-15(18-11)19(2)10-9-12-5-3-4-6-13(12)16/h3-8H,9-10,17H2,1-2H3
InChIKeyRRKDPKWOGHCWSG-UHFFFAOYSA-N
XLogP3.41
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.23
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[2-(2-bromophenyl)ethyl]-2-N,4-dimethylpyridine-2,5-diamine
CID 115147511
2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine
CID 115147764
1-N-[2-(2-bromophenyl)ethyl]-1-N,4-dimethylbenzene-1,2-diamine
CID 115125164
3-amino-6-[(2-bromophenyl)methyl-methylamino]pyridine-2-carbonitrile
CID 103467785
5-bromo-N,6-dimethyl-N-(4-methylpentyl)pyridin-2-amine
CID 115148353
N-[2-(2-bromophenyl)ethyl]-N-methylpropan-2-amine
CID 117044248
6-methyl-2-N,2-N-dipropylpyridine-2,5-diamine
CID 58282940
5-bromo-N-(3-methoxypropyl)-N,6-dimethylpyridin-2-amine
CID 103915135
2-N-methyl-2-N-(2-phenylethyl)-6-propoxypyridine-2,5-diamine
CID 65482936
N'-[2-(2-bromophenyl)ethyl]-N'-methyl-2-propan-2-ylpropane-1,3-diamine
CID 115252622
6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine
CID 63962798
2-N-[2-(2-bromophenyl)ethyl]-2-N-methylpropane-1,2-diamine
CID 117040195

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine?
The IUPAC name of 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine (CID 115147784) is 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine?
The canonical SMILES for 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine is Cc1nc(N(C)CCc2ccccc2Br)ccc1N.
What is the InChIKey of 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine?
The InChIKey is RRKDPKWOGHCWSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3/c1-11-14(17)7-8-15(18-11)19(2)10-9-12-5-3-4-6-13(12)16/h3-8H,9-10,17H2,1-2H3.
What are the key properties of 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine?
2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine has a molecular weight of 320.23 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine is sourced from PubChem (CID 115147784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).