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

C18H18N4O2S — CID 23585560

IUPAC4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide
SMILESNC(=O)c1cnc(N)c2cc(-c3ccc(N4CCOCC4)cc3)sc12
InChIInChI=1S/C18H18N4O2S/c19-17-13-9-15(25-16(13)14(10-21-17)18(20)23)11-1-3-12(4-2-11)22-5-7-24-8-6-22/h1-4,9-10H,5-8H2,(H2,19,21)(H2,20,23)
InChIKeyDZFFBPVWOUUHPX-UHFFFAOYSA-N
MW354.44 g/mol
LogP2.48
Rot. Bonds3

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

4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide (PubChem CID 23585560) has the molecular formula C18H18N4O2S and a molecular weight of 354.44 g/mol. Its IUPAC name is 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide
PubChem CID23585560
Molecular FormulaC18H18N4O2S
Molecular Weight354.44 g/mol
Exact Mass354.12
IUPAC Name4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide
SMILESNC(=O)c1cnc(N)c2cc(-c3ccc(N4CCOCC4)cc3)sc12
InChIInChI=1S/C18H18N4O2S/c19-17-13-9-15(25-16(13)14(10-21-17)18(20)23)11-1-3-12(4-2-11)22-5-7-24-8-6-22/h1-4,9-10H,5-8H2,(H2,19,21)(H2,20,23)
InChIKeyDZFFBPVWOUUHPX-UHFFFAOYSA-N
XLogP2.48
TPSA94.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.44
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The IUPAC name of 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide (CID 23585560) is 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide.
What is the SMILES notation for 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The canonical SMILES for 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide is NC(=O)c1cnc(N)c2cc(-c3ccc(N4CCOCC4)cc3)sc12.
What is the InChIKey of 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The InChIKey is DZFFBPVWOUUHPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2S/c19-17-13-9-15(25-16(13)14(10-21-17)18(20)23)11-1-3-12(4-2-11)22-5-7-24-8-6-22/h1-4,9-10H,5-8H2,(H2,19,21)(H2,20,23).
What are the key properties of 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide has a molecular weight of 354.44 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(4-morpholin-4-ylphenyl)thieno[3,2-c]pyridine-7-carboxamide is sourced from PubChem (CID 23585560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).