5-ethenyl-2-N-methylpyridine-2,3-diamine

C8H11N3 — CID 74890327

IUPAC5-ethenyl-2-N-methylpyridine-2,3-diamine
SMILESC=Cc1cnc(NC)c(N)c1
InChIInChI=1S/C8H11N3/c1-3-6-4-7(9)8(10-2)11-5-6/h3-5H,1,9H2,2H3,(H,10,11)
InChIKeyKMTPLAPEIZGPPR-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.35
Rot. Bonds2

About 5-ethenyl-2-N-methylpyridine-2,3-diamine

5-ethenyl-2-N-methylpyridine-2,3-diamine (PubChem CID 74890327) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 5-ethenyl-2-N-methylpyridine-2,3-diamine.

Molecular Properties

Compound Name5-ethenyl-2-N-methylpyridine-2,3-diamine
PubChem CID74890327
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name5-ethenyl-2-N-methylpyridine-2,3-diamine
SMILESC=Cc1cnc(NC)c(N)c1
InChIInChI=1S/C8H11N3/c1-3-6-4-7(9)8(10-2)11-5-6/h3-5H,1,9H2,2H3,(H,10,11)
InChIKeyKMTPLAPEIZGPPR-UHFFFAOYSA-N
XLogP1.35
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-2-N-methylpyridine-2,3-diamine?
The IUPAC name of 5-ethenyl-2-N-methylpyridine-2,3-diamine (CID 74890327) is 5-ethenyl-2-N-methylpyridine-2,3-diamine.
What is the SMILES notation for 5-ethenyl-2-N-methylpyridine-2,3-diamine?
The canonical SMILES for 5-ethenyl-2-N-methylpyridine-2,3-diamine is C=Cc1cnc(NC)c(N)c1.
What is the InChIKey of 5-ethenyl-2-N-methylpyridine-2,3-diamine?
The InChIKey is KMTPLAPEIZGPPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-3-6-4-7(9)8(10-2)11-5-6/h3-5H,1,9H2,2H3,(H,10,11).
What are the key properties of 5-ethenyl-2-N-methylpyridine-2,3-diamine?
5-ethenyl-2-N-methylpyridine-2,3-diamine has a molecular weight of 149.20 g/mol, XLogP of 1.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-2-N-methylpyridine-2,3-diamine is sourced from PubChem (CID 74890327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).