(4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine

C12H15N3OS — CID 61338182

IUPAC(4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine
SMILESNCC1CN(c2nccc3sccc23)CCO1
InChIInChI=1S/C12H15N3OS/c13-7-9-8-15(4-5-16-9)12-10-2-6-17-11(10)1-3-14-12/h1-3,6,9H,4-5,7-8,13H2
InChIKeyFZYUPUPGPZPKQK-UHFFFAOYSA-N
MW249.34 g/mol
LogP1.46
Rot. Bonds2

About (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine

(4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine (PubChem CID 61338182) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine
PubChem CID61338182
Molecular FormulaC12H15N3OS
Molecular Weight249.34 g/mol
Exact Mass249.09
IUPAC Name(4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine
SMILESNCC1CN(c2nccc3sccc23)CCO1
InChIInChI=1S/C12H15N3OS/c13-7-9-8-15(4-5-16-9)12-10-2-6-17-11(10)1-3-14-12/h1-3,6,9H,4-5,7-8,13H2
InChIKeyFZYUPUPGPZPKQK-UHFFFAOYSA-N
XLogP1.46
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine?
The IUPAC name of (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine (CID 61338182) is (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine.
What is the SMILES notation for (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine?
The canonical SMILES for (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine is NCC1CN(c2nccc3sccc23)CCO1.
What is the InChIKey of (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine?
The InChIKey is FZYUPUPGPZPKQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3OS/c13-7-9-8-15(4-5-16-9)12-10-2-6-17-11(10)1-3-14-12/h1-3,6,9H,4-5,7-8,13H2.
What are the key properties of (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine?
(4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine has a molecular weight of 249.34 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine is sourced from PubChem (CID 61338182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).