4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide

C79H69N19O6S5 — CID 160778424

IUPAC4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide
SMILESCC(C#N)c1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.CCc1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.CN(C)c1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.N#CCOc1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.NC(=O)c1cnc(N)c2cc(-c3ccc(N)cc3)sc12
InChIInChI=1S/C17H14N4OS.C16H12N4O2S.C16H16N4OS.C16H15N3OS.C14H12N4OS/c1-9(7-18)10-2-4-11(5-3-10)14-6-12-15(23-14)13(17(20)22)8-21-16(12)19;17-5-6-22-10-3-1-9(2-4-10)13-7-11-14(23-13)12(16(19)21)8-20-15(11)18;1-20(2)10-5-3-9(4-6-10)13-7-11-14(22-13)12(16(18)21)8-19-15(11)17;1-2-9-3-5-10(6-4-9)13-7-11-14(21-13)12(16(18)20)8-19-15(11)17;15-8-3-1-7(2-4-8)11-5-9-12(20-11)10(14(17)19)6-18-13(9)16/h2-6,8-9H,1H3,(H2,19,21)(H2,20,22);1-4,7-8H,6H2,(H2,18,20)(H2,19,21);3-8H,1-2H3,(H2,17,19)(H2,18,21);3-8H,2H2,1H3,(H2,17,19)(H2,18,20);1-6H,15H2,(H2,16,18)(H2,17,19)
InChIKeySAGHSLUECBHGHS-UHFFFAOYSA-N
MW1540.88 g/mol
LogP13.96
Rot. Bonds15

About 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide

4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide (PubChem CID 160778424) has the molecular formula C79H69N19O6S5 and a molecular weight of 1540.88 g/mol. Its IUPAC name is 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide
PubChem CID160778424
Molecular FormulaC79H69N19O6S5
Molecular Weight1540.88 g/mol
Exact Mass1539.43
IUPAC Name4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide
SMILESCC(C#N)c1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.CCc1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.CN(C)c1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.N#CCOc1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.NC(=O)c1cnc(N)c2cc(-c3ccc(N)cc3)sc12
InChIInChI=1S/C17H14N4OS.C16H12N4O2S.C16H16N4OS.C16H15N3OS.C14H12N4OS/c1-9(7-18)10-2-4-11(5-3-10)14-6-12-15(23-14)13(17(20)22)8-21-16(12)19;17-5-6-22-10-3-1-9(2-4-10)13-7-11-14(23-13)12(16(19)21)8-20-15(11)18;1-20(2)10-5-3-9(4-6-10)13-7-11-14(22-13)12(16(18)21)8-19-15(11)17;1-2-9-3-5-10(6-4-9)13-7-11-14(21-13)12(16(18)20)8-19-15(11)17;15-8-3-1-7(2-4-8)11-5-9-12(20-11)10(14(17)19)6-18-13(9)16/h2-6,8-9H,1H3,(H2,19,21)(H2,20,22);1-4,7-8H,6H2,(H2,18,20)(H2,19,21);3-8H,1-2H3,(H2,17,19)(H2,18,21);3-8H,2H2,1H3,(H2,17,19)(H2,18,20);1-6H,15H2,(H2,16,18)(H2,17,19)
InChIKeySAGHSLUECBHGHS-UHFFFAOYSA-N
XLogP13.96
TPSA496.07 Ų
H-Bond Donors11
H-Bond Acceptors25
Rotatable Bonds15
Heavy Atoms109
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001540.88
LogP ≤ 513.96
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The IUPAC name of 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide (CID 160778424) is 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide.
What is the SMILES notation for 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The canonical SMILES for 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide is CC(C#N)c1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.CCc1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.CN(C)c1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.N#CCOc1ccc(-c2cc3c(N)ncc(C(N)=O)c3s2)cc1.NC(=O)c1cnc(N)c2cc(-c3ccc(N)cc3)sc12.
What is the InChIKey of 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
The InChIKey is SAGHSLUECBHGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4OS.C16H12N4O2S.C16H16N4OS.C16H15N3OS.C14H12N4OS/c1-9(7-18)10-2-4-11(5-3-10)14-6-12-15(23-14)13(17(20)22)8-21-16(12)19;17-5-6-22-10-3-1-9(2-4-10)13-7-11-14(23-13)12(16(19)21)8-20-15(11)18;1-20(2)10-5-3-9(4-6-10)13-7-11-14(22-13)12(16(18)21)8-19-15(11)17;1-2-9-3-5-10(6-4-9)13-7-11-14(21-13)12(16(18)20)8-19-15(11)17;15-8-3-1-7(2-4-8)11-5-9-12(20-11)10(14(17)19)6-18-13(9)16/h2-6,8-9H,1H3,(H2,19,21)(H2,20,22);1-4,7-8H,6H2,(H2,18,20)(H2,19,21);3-8H,1-2H3,(H2,17,19)(H2,18,21);3-8H,2H2,1H3,(H2,17,19)(H2,18,20);1-6H,15H2,(H2,16,18)(H2,17,19).
What are the key properties of 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide?
4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide has a molecular weight of 1540.88 g/mol, XLogP of 13.96, 15 rotatable bonds, 11 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(4-aminophenyl)thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(1-cyanoethyl)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(cyanomethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-[4-(dimethylamino)phenyl]thieno[3,2-c]pyridine-7-carboxamide;4-amino-2-(4-ethylphenyl)thieno[3,2-c]pyridine-7-carboxamide is sourced from PubChem (CID 160778424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).