5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine

C14H17N3S — CID 83265918

IUPAC5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine
SMILESCc1cnc(N2CCc3sccc3C2C)cc1N
InChIInChI=1S/C14H17N3S/c1-9-8-16-14(7-12(9)15)17-5-3-13-11(10(17)2)4-6-18-13/h4,6-8,10H,3,5H2,1-2H3,(H2,15,16)
InChIKeyLSMBCZVNXBXJSA-UHFFFAOYSA-N
MW259.38 g/mol
LogP3.16
Rot. Bonds1

About 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine

5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine (PubChem CID 83265918) has the molecular formula C14H17N3S and a molecular weight of 259.38 g/mol. Its IUPAC name is 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine.

Molecular Properties

Compound Name5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine
PubChem CID83265918
Molecular FormulaC14H17N3S
Molecular Weight259.38 g/mol
Exact Mass259.11
IUPAC Name5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine
SMILESCc1cnc(N2CCc3sccc3C2C)cc1N
InChIInChI=1S/C14H17N3S/c1-9-8-16-14(7-12(9)15)17-5-3-13-11(10(17)2)4-6-18-13/h4,6-8,10H,3,5H2,1-2H3,(H2,15,16)
InChIKeyLSMBCZVNXBXJSA-UHFFFAOYSA-N
XLogP3.16
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine?
The IUPAC name of 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine (CID 83265918) is 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine.
What is the SMILES notation for 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine?
The canonical SMILES for 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine is Cc1cnc(N2CCc3sccc3C2C)cc1N.
What is the InChIKey of 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine?
The InChIKey is LSMBCZVNXBXJSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3S/c1-9-8-16-14(7-12(9)15)17-5-3-13-11(10(17)2)4-6-18-13/h4,6-8,10H,3,5H2,1-2H3,(H2,15,16).
What are the key properties of 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine?
5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine has a molecular weight of 259.38 g/mol, XLogP of 3.16, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-4-amine is sourced from PubChem (CID 83265918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).