4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide

C20H22N4O2S — CID 56925356

IUPAC4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide
SMILESCCNC(=O)c1cnc(N)c2cc(-c3ccc(N4CCOCC4)cc3)sc12
InChIInChI=1S/C20H22N4O2S/c1-2-22-20(25)16-12-23-19(21)15-11-17(27-18(15)16)13-3-5-14(6-4-13)24-7-9-26-10-8-24/h3-6,11-12H,2,7-10H2,1H3,(H2,21,23)(H,22,25)
InChIKeyMWEYUGKSUFPEAR-UHFFFAOYSA-N
MW382.49 g/mol
LogP3.13
Rot. Bonds4

About 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide

4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide (PubChem CID 56925356) has the molecular formula C20H22N4O2S and a molecular weight of 382.49 g/mol. Its IUPAC name is 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide
PubChem CID56925356
Molecular FormulaC20H22N4O2S
Molecular Weight382.49 g/mol
Exact Mass382.15
IUPAC Name4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide
SMILESCCNC(=O)c1cnc(N)c2cc(-c3ccc(N4CCOCC4)cc3)sc12
InChIInChI=1S/C20H22N4O2S/c1-2-22-20(25)16-12-23-19(21)15-11-17(27-18(15)16)13-3-5-14(6-4-13)24-7-9-26-10-8-24/h3-6,11-12H,2,7-10H2,1H3,(H2,21,23)(H,22,25)
InChIKeyMWEYUGKSUFPEAR-UHFFFAOYSA-N
XLogP3.13
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.49
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The IUPAC name of 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide (CID 56925356) is 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide.
What is the SMILES notation for 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The canonical SMILES for 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide is CCNC(=O)c1cnc(N)c2cc(-c3ccc(N4CCOCC4)cc3)sc12.
What is the InChIKey of 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The InChIKey is MWEYUGKSUFPEAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2S/c1-2-22-20(25)16-12-23-19(21)15-11-17(27-18(15)16)13-3-5-14(6-4-13)24-7-9-26-10-8-24/h3-6,11-12H,2,7-10H2,1H3,(H2,21,23)(H,22,25).
What are the key properties of 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide has a molecular weight of 382.49 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide is sourced from PubChem (CID 56925356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).