5-(2-methylpropyl)pyridin-3-amine

C9H14N2 — CID 82417429

IUPAC5-(2-methylpropyl)pyridin-3-amine
SMILESCC(C)Cc1cncc(N)c1
InChIInChI=1S/C9H14N2/c1-7(2)3-8-4-9(10)6-11-5-8/h4-7H,3,10H2,1-2H3
InChIKeyLPULHXMEKAUKMK-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.86
Rot. Bonds2

About 5-(2-methylpropyl)pyridin-3-amine

5-(2-methylpropyl)pyridin-3-amine (PubChem CID 82417429) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 5-(2-methylpropyl)pyridin-3-amine.

Molecular Properties

Compound Name5-(2-methylpropyl)pyridin-3-amine
PubChem CID82417429
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name5-(2-methylpropyl)pyridin-3-amine
SMILESCC(C)Cc1cncc(N)c1
InChIInChI=1S/C9H14N2/c1-7(2)3-8-4-9(10)6-11-5-8/h4-7H,3,10H2,1-2H3
InChIKeyLPULHXMEKAUKMK-UHFFFAOYSA-N
XLogP1.86
TPSA38.91 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 ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-(2-methylpropyl)pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)pyridin-3-amine?
The IUPAC name of 5-(2-methylpropyl)pyridin-3-amine (CID 82417429) is 5-(2-methylpropyl)pyridin-3-amine.
What is the SMILES notation for 5-(2-methylpropyl)pyridin-3-amine?
The canonical SMILES for 5-(2-methylpropyl)pyridin-3-amine is CC(C)Cc1cncc(N)c1.
What is the InChIKey of 5-(2-methylpropyl)pyridin-3-amine?
The InChIKey is LPULHXMEKAUKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-7(2)3-8-4-9(10)6-11-5-8/h4-7H,3,10H2,1-2H3.
What are the key properties of 5-(2-methylpropyl)pyridin-3-amine?
5-(2-methylpropyl)pyridin-3-amine has a molecular weight of 150.22 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)pyridin-3-amine is sourced from PubChem (CID 82417429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).