N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine

C₁₅H₂₁N₃OS — CID 133352657

About N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine

N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine (PubChem CID 133352657) has the molecular formula C₁₅H₂₁N₃OS and a molecular weight of 291.42 g/mol. Its IUPAC name is N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine.

Molecular Properties

• Compound Name: N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine
• PubChem CID: 133352657
• Molecular Formula: C₁₅H₂₁N₃OS
• Molecular Weight: 291.42 g/mol
• Exact Mass: 291.14
• IUPAC Name: N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine
• SMILES: CC(CNc1ccnc2ccsc12)N1CCOCC1C
• InChI: InChI=1S/C15H21N3OS/c1-11(18-6-7-19-10-12(18)2)9-17-13-3-5-16-14-4-8-20-15(13)14/h3-5,8,11-12H,6-7,9-10H2,1-2H3,(H,16,17)
• InChIKey: LTFDDWSPQKFKDF-UHFFFAOYSA-N
• XLogP: 2.82
• TPSA: 37.39 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	291.42
LogP ≤ 5	2.82
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine?

The IUPAC name of N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine (CID 133352657) is N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine.

What is the SMILES notation for N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine?

The canonical SMILES for N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine is CC(CNc1ccnc2ccsc12)N1CCOCC1C.

What is the InChIKey of N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine?

The InChIKey is LTFDDWSPQKFKDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3OS/c1-11(18-6-7-19-10-12(18)2)9-17-13-3-5-16-14-4-8-20-15(13)14/h3-5,8,11-12H,6-7,9-10H2,1-2H3,(H,16,17).

What are the key properties of N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine?

N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine has a molecular weight of 291.42 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine is sourced from PubChem (CID 133352657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 133352657 — identifiers, structure, computed properties (public domain)

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