6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine

C14H18N2S — CID 54962999

IUPAC6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine
SMILESCCCC(Nc1cccc(C)n1)c1cccs1
InChIInChI=1S/C14H18N2S/c1-3-6-12(13-8-5-10-17-13)16-14-9-4-7-11(2)15-14/h4-5,7-10,12H,3,6H2,1-2H3,(H,15,16)
InChIKeySBXMNWDOVKXFOZ-UHFFFAOYSA-N
MW246.38 g/mol
LogP4.40
Rot. Bonds5

About 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine

6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine (PubChem CID 54962999) has the molecular formula C14H18N2S and a molecular weight of 246.38 g/mol. Its IUPAC name is 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine.

Molecular Properties

Compound Name6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine
PubChem CID54962999
Molecular FormulaC14H18N2S
Molecular Weight246.38 g/mol
Exact Mass246.12
IUPAC Name6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine
SMILESCCCC(Nc1cccc(C)n1)c1cccs1
InChIInChI=1S/C14H18N2S/c1-3-6-12(13-8-5-10-17-13)16-14-9-4-7-11(2)15-14/h4-5,7-10,12H,3,6H2,1-2H3,(H,15,16)
InChIKeySBXMNWDOVKXFOZ-UHFFFAOYSA-N
XLogP4.40
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine?
The IUPAC name of 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine (CID 54962999) is 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine.
What is the SMILES notation for 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine?
The canonical SMILES for 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine is CCCC(Nc1cccc(C)n1)c1cccs1.
What is the InChIKey of 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine?
The InChIKey is SBXMNWDOVKXFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2S/c1-3-6-12(13-8-5-10-17-13)16-14-9-4-7-11(2)15-14/h4-5,7-10,12H,3,6H2,1-2H3,(H,15,16).
What are the key properties of 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine?
6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine has a molecular weight of 246.38 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(1-thiophen-2-ylbutyl)pyridin-2-amine is sourced from PubChem (CID 54962999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).