6-methyl-N-prop-2-enylpyridin-2-amine

C9H12N2 — CID 11086561

IUPAC6-methyl-N-prop-2-enylpyridin-2-amine
SMILESC=CCNc1cccc(C)n1
InChIInChI=1S/C9H12N2/c1-3-7-10-9-6-4-5-8(2)11-9/h3-6H,1,7H2,2H3,(H,10,11)
InChIKeyWMCWAOGSYXJOJR-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.99
Rot. Bonds3

About 6-methyl-N-prop-2-enylpyridin-2-amine

6-methyl-N-prop-2-enylpyridin-2-amine (PubChem CID 11086561) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 6-methyl-N-prop-2-enylpyridin-2-amine.

Molecular Properties

Compound Name6-methyl-N-prop-2-enylpyridin-2-amine
PubChem CID11086561
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name6-methyl-N-prop-2-enylpyridin-2-amine
SMILESC=CCNc1cccc(C)n1
InChIInChI=1S/C9H12N2/c1-3-7-10-9-6-4-5-8(2)11-9/h3-6H,1,7H2,2H3,(H,10,11)
InChIKeyWMCWAOGSYXJOJR-UHFFFAOYSA-N
XLogP1.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-prop-2-enylpyridin-2-amine?
The IUPAC name of 6-methyl-N-prop-2-enylpyridin-2-amine (CID 11086561) is 6-methyl-N-prop-2-enylpyridin-2-amine.
What is the SMILES notation for 6-methyl-N-prop-2-enylpyridin-2-amine?
The canonical SMILES for 6-methyl-N-prop-2-enylpyridin-2-amine is C=CCNc1cccc(C)n1.
What is the InChIKey of 6-methyl-N-prop-2-enylpyridin-2-amine?
The InChIKey is WMCWAOGSYXJOJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-3-7-10-9-6-4-5-8(2)11-9/h3-6H,1,7H2,2H3,(H,10,11).
What are the key properties of 6-methyl-N-prop-2-enylpyridin-2-amine?
6-methyl-N-prop-2-enylpyridin-2-amine has a molecular weight of 148.21 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-prop-2-enylpyridin-2-amine is sourced from PubChem (CID 11086561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).