6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine

C14H15F2N3 — CID 103587849

IUPAC6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine
SMILESCCNc1cccc(Nc2cc(F)c(C)cc2F)n1
InChIInChI=1S/C14H15F2N3/c1-3-17-13-5-4-6-14(19-13)18-12-8-10(15)9(2)7-11(12)16/h4-8H,3H2,1-2H3,(H2,17,18,19)
InChIKeyATWANXZJCDSVGN-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.84
Rot. Bonds4

About 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine

6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine (PubChem CID 103587849) has the molecular formula C14H15F2N3 and a molecular weight of 263.29 g/mol. Its IUPAC name is 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine
PubChem CID103587849
Molecular FormulaC14H15F2N3
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC Name6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine
SMILESCCNc1cccc(Nc2cc(F)c(C)cc2F)n1
InChIInChI=1S/C14H15F2N3/c1-3-17-13-5-4-6-14(19-13)18-12-8-10(15)9(2)7-11(12)16/h4-8H,3H2,1-2H3,(H2,17,18,19)
InChIKeyATWANXZJCDSVGN-UHFFFAOYSA-N
XLogP3.84
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine
CID 103587838
2-N-ethyl-6-N-(3-fluoro-2-methylphenyl)pyridine-2,6-diamine
CID 80814736
2-N-ethyl-6-N-(3,4,5-trifluorophenyl)pyridine-2,6-diamine
CID 80824451
6-N-(4-bromo-2-methylphenyl)-2-N-ethylpyridine-2,6-diamine
CID 80759261
2-N-ethyl-6-N-(4-fluoro-2-iodophenyl)pyridine-2,6-diamine
CID 80849440
4-N-(2,5-difluoro-4-methylphenyl)-2-N-ethyl-5-methylpyrimidine-2,4-diamine
CID 103587790
2-N-ethyl-6-N-(2-propylphenyl)pyridine-2,6-diamine
CID 80807820
N-(2,5-difluoro-4-methylphenyl)-6-hydrazinylpyrazin-2-amine
CID 103587925
6-N-[(3,4-difluorophenyl)methyl]-2-N-ethylpyridine-2,6-diamine
CID 80805276
N-(2,5-difluoro-4-methylphenyl)-2-ethyl-6-hydrazinylpyrimidin-4-amine
CID 103587913
5-chloro-4-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyrimidine-2,4-diamine
CID 103587868
6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine
CID 80798545

Frequently Asked Questions

What is the IUPAC name of 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine?
The IUPAC name of 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine (CID 103587849) is 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine?
The canonical SMILES for 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine is CCNc1cccc(Nc2cc(F)c(C)cc2F)n1.
What is the InChIKey of 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine?
The InChIKey is ATWANXZJCDSVGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3/c1-3-17-13-5-4-6-14(19-13)18-12-8-10(15)9(2)7-11(12)16/h4-8H,3H2,1-2H3,(H2,17,18,19).
What are the key properties of 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine?
6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine has a molecular weight of 263.29 g/mol, XLogP of 3.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine is sourced from PubChem (CID 103587849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).