3-ethyl-5-ethynyl-6-methylpyridin-2-amine

C10H12N2 — CID 74889226

IUPAC3-ethyl-5-ethynyl-6-methylpyridin-2-amine
SMILESC#Cc1cc(CC)c(N)nc1C
InChIInChI=1S/C10H12N2/c1-4-8-6-9(5-2)10(11)12-7(8)3/h1,6H,5H2,2-3H3,(H2,11,12)
InChIKeyDQZJGCHPQNBAMJ-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.52
Rot. Bonds1

About 3-ethyl-5-ethynyl-6-methylpyridin-2-amine

3-ethyl-5-ethynyl-6-methylpyridin-2-amine (PubChem CID 74889226) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 3-ethyl-5-ethynyl-6-methylpyridin-2-amine.

Molecular Properties

Compound Name3-ethyl-5-ethynyl-6-methylpyridin-2-amine
PubChem CID74889226
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name3-ethyl-5-ethynyl-6-methylpyridin-2-amine
SMILESC#Cc1cc(CC)c(N)nc1C
InChIInChI=1S/C10H12N2/c1-4-8-6-9(5-2)10(11)12-7(8)3/h1,6H,5H2,2-3H3,(H2,11,12)
InChIKeyDQZJGCHPQNBAMJ-UHFFFAOYSA-N
XLogP1.52
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-ethynyl-6-methylpyridin-2-amine?
The IUPAC name of 3-ethyl-5-ethynyl-6-methylpyridin-2-amine (CID 74889226) is 3-ethyl-5-ethynyl-6-methylpyridin-2-amine.
What is the SMILES notation for 3-ethyl-5-ethynyl-6-methylpyridin-2-amine?
The canonical SMILES for 3-ethyl-5-ethynyl-6-methylpyridin-2-amine is C#Cc1cc(CC)c(N)nc1C.
What is the InChIKey of 3-ethyl-5-ethynyl-6-methylpyridin-2-amine?
The InChIKey is DQZJGCHPQNBAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-4-8-6-9(5-2)10(11)12-7(8)3/h1,6H,5H2,2-3H3,(H2,11,12).
What are the key properties of 3-ethyl-5-ethynyl-6-methylpyridin-2-amine?
3-ethyl-5-ethynyl-6-methylpyridin-2-amine has a molecular weight of 160.22 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-ethynyl-6-methylpyridin-2-amine is sourced from PubChem (CID 74889226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).