3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide

C18H16N4OS — CID 23916903

IUPAC3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
SMILESCCCc1ccc2c(N)c(C(=O)Nc3ccc(C#N)cc3)sc2n1
InChIInChI=1S/C18H16N4OS/c1-2-3-12-8-9-14-15(20)16(24-18(14)22-12)17(23)21-13-6-4-11(10-19)5-7-13/h4-9H,2-3,20H2,1H3,(H,21,23)
InChIKeyZDUDPMCNSBFWFC-UHFFFAOYSA-N
MW336.42 g/mol
LogP3.95
Rot. Bonds4

About 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide

3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 23916903) has the molecular formula C18H16N4OS and a molecular weight of 336.42 g/mol. Its IUPAC name is 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
PubChem CID23916903
Molecular FormulaC18H16N4OS
Molecular Weight336.42 g/mol
Exact Mass336.10
IUPAC Name3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
SMILESCCCc1ccc2c(N)c(C(=O)Nc3ccc(C#N)cc3)sc2n1
InChIInChI=1S/C18H16N4OS/c1-2-3-12-8-9-14-15(20)16(24-18(14)22-12)17(23)21-13-6-4-11(10-19)5-7-13/h4-9H,2-3,20H2,1H3,(H,21,23)
InChIKeyZDUDPMCNSBFWFC-UHFFFAOYSA-N
XLogP3.95
TPSA91.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-naphthalen-2-yl-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23916901
3-amino-N-[4-(4-nitrophenyl)sulfanylphenyl]-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23944857
3-amino-N-(3-methylphenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23745667
ethyl 5-[(3-amino-6-propylthieno[2,3-b]pyridine-2-carbonyl)amino]-4-cyano-3-methylthiophene-2-carboxylate
CID 23914236
N-[4-(acetylsulfamoyl)phenyl]-3-amino-6-butylthieno[2,3-b]pyridine-2-carboxamide
CID 25038545
3-amino-6-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]thieno[2,3-b]pyridine-2-carboxamide
CID 87047894
3-amino-N-(4-ethoxyphenyl)-6-(2-methylpropyl)thieno[2,3-b]pyridine-2-carboxamide
CID 23745634
N-(4-acetamidophenyl)-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide
CID 23944865
3-[(3-amino-6-butylthieno[2,3-b]pyridine-2-carbonyl)amino]benzoic acid
CID 21233452
ethyl 2-[2-[(3-amino-6-propylthieno[2,3-b]pyridine-2-carbonyl)amino]-1,3-thiazol-5-yl]acetate
CID 23972899
3-amino-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23914370
3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23830180

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide (CID 23916903) is 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide is CCCc1ccc2c(N)c(C(=O)Nc3ccc(C#N)cc3)sc2n1.
What is the InChIKey of 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is ZDUDPMCNSBFWFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4OS/c1-2-3-12-8-9-14-15(20)16(24-18(14)22-12)17(23)21-13-6-4-11(10-19)5-7-13/h4-9H,2-3,20H2,1H3,(H,21,23).
What are the key properties of 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 336.42 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-cyanophenyl)-6-propylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 23916903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).