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

C17H23N3 — CID 115147764

IUPAC2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine
SMILESCc1ccc(C)c(CCN(C)c2ccc(N)c(C)n2)c1
InChIInChI=1S/C17H23N3/c1-12-5-6-13(2)15(11-12)9-10-20(4)17-8-7-16(18)14(3)19-17/h5-8,11H,9-10,18H2,1-4H3
InChIKeyKXXFFEZAAGRHMC-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.27
Rot. Bonds4

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

2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine (PubChem CID 115147764) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine
PubChem CID115147764
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine
SMILESCc1ccc(C)c(CCN(C)c2ccc(N)c(C)n2)c1
InChIInChI=1S/C17H23N3/c1-12-5-6-13(2)15(11-12)9-10-20(4)17-8-7-16(18)14(3)19-17/h5-8,11H,9-10,18H2,1-4H3
InChIKeyKXXFFEZAAGRHMC-UHFFFAOYSA-N
XLogP3.27
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[2-(2-bromophenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine
CID 115147784
2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N-methylbenzene-1,2-diamine
CID 115124611
2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,2-dimethylpropane-1,2-diamine
CID 115132235
1-N-[2-(5-bromo-2-methylphenyl)ethyl]-1-N,4-dimethylbenzene-1,2-diamine
CID 115125153
[2-(2,5-dimethylphenyl)ethyl-methylamino]methanethiol
CID 115228360
N-(bromomethyl)-2-(2,5-dimethylphenyl)-N-methylethanamine
CID 115262334
2-N-[(5-bromo-2-fluorophenyl)methyl]-2-N,6-dimethylpyridine-2,5-diamine
CID 115147720
6-methyl-2-N,2-N-dipropylpyridine-2,5-diamine
CID 58282940
2-(2,5-dimethylphenyl)-N-(methoxymethyl)-N-methylethanamine
CID 115258971
1-amino-N-[2-(2,5-dimethylphenyl)ethyl]-N-methylcyclopropane-1-carboxamide
CID 115190000
2-amino-N-[2-(2,5-dimethylphenyl)ethyl]-N-methylacetamide
CID 82127686
N'-[2-(2,5-dimethylphenyl)ethyl]-N,N'-dimethylbutane-1,4-diamine
CID 115202182

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine?
The IUPAC name of 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine (CID 115147764) is 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine?
The canonical SMILES for 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine is Cc1ccc(C)c(CCN(C)c2ccc(N)c(C)n2)c1.
What is the InChIKey of 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine?
The InChIKey is KXXFFEZAAGRHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-12-5-6-13(2)15(11-12)9-10-20(4)17-8-7-16(18)14(3)19-17/h5-8,11H,9-10,18H2,1-4H3.
What are the key properties of 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine?
2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine has a molecular weight of 269.39 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-(2,5-dimethylphenyl)ethyl]-2-N,6-dimethylpyridine-2,5-diamine is sourced from PubChem (CID 115147764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).