6-methyl-2-N-phenylpyridine-2,3-diamine

C12H13N3 — CID 79003921

IUPAC6-methyl-2-N-phenylpyridine-2,3-diamine
SMILESCc1ccc(N)c(Nc2ccccc2)n1
InChIInChI=1S/C12H13N3/c1-9-7-8-11(13)12(14-9)15-10-5-3-2-4-6-10/h2-8H,13H2,1H3,(H,14,15)
InChIKeyMTHFOXUPFQTKJZ-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.72
Rot. Bonds2

About 6-methyl-2-N-phenylpyridine-2,3-diamine

6-methyl-2-N-phenylpyridine-2,3-diamine (PubChem CID 79003921) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 6-methyl-2-N-phenylpyridine-2,3-diamine.

Molecular Properties

Compound Name6-methyl-2-N-phenylpyridine-2,3-diamine
PubChem CID79003921
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name6-methyl-2-N-phenylpyridine-2,3-diamine
SMILESCc1ccc(N)c(Nc2ccccc2)n1
InChIInChI=1S/C12H13N3/c1-9-7-8-11(13)12(14-9)15-10-5-3-2-4-6-10/h2-8H,13H2,1H3,(H,14,15)
InChIKeyMTHFOXUPFQTKJZ-UHFFFAOYSA-N
XLogP2.72
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine
CID 81140251
4-[(3-amino-6-methyl-2-pyridinyl)amino]phenol
CID 82061053
2-N-(4-chlorophenyl)-6-methylpyridine-2,3-diamine
CID 79020853
6-methyl-2-N-(3-methylsulfanylphenyl)pyridine-2,3-diamine
CID 79020854
CID 88886077
CID 88886077
4-[(3-amino-6-methyl-2-pyridinyl)amino]benzenesulfonamide
CID 82059643
6-methyl-2-N-[3-(trifluoromethyl)phenyl]pyridine-2,3-diamine
CID 79021968
2-N-phenyl-6-(trifluoromethyl)pyridine-2,3-diamine
CID 70979281
2-N-[3-(dimethylamino)-4-methylphenyl]-6-methylpyridine-2,3-diamine
CID 115376279
2-N-(3-butan-2-yloxyphenyl)-6-methylpyridine-2,3-diamine
CID 81133161
2-N-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methylpyridine-2,3-diamine
CID 81132199
3,6-dimethyl-N-phenylpyrazin-2-amine
CID 518389

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-N-phenylpyridine-2,3-diamine?
The IUPAC name of 6-methyl-2-N-phenylpyridine-2,3-diamine (CID 79003921) is 6-methyl-2-N-phenylpyridine-2,3-diamine.
What is the SMILES notation for 6-methyl-2-N-phenylpyridine-2,3-diamine?
The canonical SMILES for 6-methyl-2-N-phenylpyridine-2,3-diamine is Cc1ccc(N)c(Nc2ccccc2)n1.
What is the InChIKey of 6-methyl-2-N-phenylpyridine-2,3-diamine?
The InChIKey is MTHFOXUPFQTKJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-9-7-8-11(13)12(14-9)15-10-5-3-2-4-6-10/h2-8H,13H2,1H3,(H,14,15).
What are the key properties of 6-methyl-2-N-phenylpyridine-2,3-diamine?
6-methyl-2-N-phenylpyridine-2,3-diamine has a molecular weight of 199.26 g/mol, XLogP of 2.72, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-N-phenylpyridine-2,3-diamine is sourced from PubChem (CID 79003921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).