3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine

C17H16N2 — CID 83170641

IUPAC3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine
SMILESCc1cc(-c2ccc(C)c3ccccc23)cnc1N
InChIInChI=1S/C17H16N2/c1-11-7-8-15(16-6-4-3-5-14(11)16)13-9-12(2)17(18)19-10-13/h3-10H,1-2H3,(H2,18,19)
InChIKeyFZXWVPDKVAFKGK-UHFFFAOYSA-N
MW248.33 g/mol
LogP4.10
Rot. Bonds1

About 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine

3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine (PubChem CID 83170641) has the molecular formula C17H16N2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine
PubChem CID83170641
Molecular FormulaC17H16N2
Molecular Weight248.33 g/mol
Exact Mass248.13
IUPAC Name3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine
SMILESCc1cc(-c2ccc(C)c3ccccc23)cnc1N
InChIInChI=1S/C17H16N2/c1-11-7-8-15(16-6-4-3-5-14(11)16)13-9-12(2)17(18)19-10-13/h3-10H,1-2H3,(H2,18,19)
InChIKeyFZXWVPDKVAFKGK-UHFFFAOYSA-N
XLogP4.10
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-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 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine?
The IUPAC name of 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine (CID 83170641) is 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine.
What is the SMILES notation for 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine?
The canonical SMILES for 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine is Cc1cc(-c2ccc(C)c3ccccc23)cnc1N.
What is the InChIKey of 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine?
The InChIKey is FZXWVPDKVAFKGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2/c1-11-7-8-15(16-6-4-3-5-14(11)16)13-9-12(2)17(18)19-10-13/h3-10H,1-2H3,(H2,18,19).
What are the key properties of 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine?
3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine has a molecular weight of 248.33 g/mol, XLogP of 4.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(4-methylnaphthalen-1-yl)pyridin-2-amine is sourced from PubChem (CID 83170641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).