6-methyl-5-prop-2-enyl-2H-pyridin-1-amine

C9H14N2 — CID 70507575

IUPAC6-methyl-5-prop-2-enyl-2H-pyridin-1-amine
SMILESC=CCC1=C(C)N(N)CC=C1
InChIInChI=1S/C9H14N2/c1-3-5-9-6-4-7-11(10)8(9)2/h3-4,6H,1,5,7,10H2,2H3
InChIKeyZOFHLCWOFMWGGR-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.58
Rot. Bonds2

About 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine

6-methyl-5-prop-2-enyl-2H-pyridin-1-amine (PubChem CID 70507575) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine.

Molecular Properties

Compound Name6-methyl-5-prop-2-enyl-2H-pyridin-1-amine
PubChem CID70507575
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name6-methyl-5-prop-2-enyl-2H-pyridin-1-amine
SMILESC=CCC1=C(C)N(N)CC=C1
InChIInChI=1S/C9H14N2/c1-3-5-9-6-4-7-11(10)8(9)2/h3-4,6H,1,5,7,10H2,2H3
InChIKeyZOFHLCWOFMWGGR-UHFFFAOYSA-N
XLogP1.58
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine?
The IUPAC name of 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine (CID 70507575) is 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine.
What is the SMILES notation for 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine?
The canonical SMILES for 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine is C=CCC1=C(C)N(N)CC=C1.
What is the InChIKey of 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine?
The InChIKey is ZOFHLCWOFMWGGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-3-5-9-6-4-7-11(10)8(9)2/h3-4,6H,1,5,7,10H2,2H3.
What are the key properties of 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine?
6-methyl-5-prop-2-enyl-2H-pyridin-1-amine has a molecular weight of 150.22 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-prop-2-enyl-2H-pyridin-1-amine is sourced from PubChem (CID 70507575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).