3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide

C15H13N3O2S — CID 4778721

IUPAC3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCOc1ccc(-c2ccc3c(N)c(C(N)=O)sc3n2)cc1
InChIInChI=1S/C15H13N3O2S/c1-20-9-4-2-8(3-5-9)11-7-6-10-12(16)13(14(17)19)21-15(10)18-11/h2-7H,16H2,1H3,(H2,17,19)
InChIKeyZKYPMAVSRIREEM-UHFFFAOYSA-N
MW299.36 g/mol
LogP2.65
Rot. Bonds3

About 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide

3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 4778721) has the molecular formula C15H13N3O2S and a molecular weight of 299.36 g/mol. Its IUPAC name is 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID4778721
Molecular FormulaC15H13N3O2S
Molecular Weight299.36 g/mol
Exact Mass299.07
IUPAC Name3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCOc1ccc(-c2ccc3c(N)c(C(N)=O)sc3n2)cc1
InChIInChI=1S/C15H13N3O2S/c1-20-9-4-2-8(3-5-9)11-7-6-10-12(16)13(14(17)19)21-15(10)18-11/h2-7H,16H2,1H3,(H2,17,19)
InChIKeyZKYPMAVSRIREEM-UHFFFAOYSA-N
XLogP2.65
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

VU0152100
CID 864492
VU0152099
CID 1541501
3,6-Diamino-5-cyano-4-(4-ethoxyphenyl)thieno(2,3-b)pyridine-2-carboxamide
CID 1916699
Methyl 3-amino-4,6-dimethylthieno(2,3-b)pyridine-2-carboxylate
CID 753694
3-amino-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]thieno[3,2-e]pyridine-2-carboxamide
CID 770990
3-amino-N-cyclopropyl-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
CID 3324427
3-amino-N-(4-methoxyphenyl)-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 689989
(3-Amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)(4-methoxyphenyl)methanone
CID 698706
(3-Amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)(2,3-dihydro-1,4-benzodioxin-6-yl)methanone
CID 1647025
3-amino-6-(3,4-dimethoxyphenyl)-N-[4-(trifluoromethyl)phenyl]thieno[2,3-b]pyridine-2-carboxamide
CID 2017205
3-Amino-N,6-bis(4-methoxyphenyl)-4-(trifluoromethyl)thieno(2,3-B)pyridine-2-carboxamide
CID 1283826
3-Amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carboxamide
CID 704064

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide (CID 4778721) is 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide is COc1ccc(-c2ccc3c(N)c(C(N)=O)sc3n2)cc1.
What is the InChIKey of 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is ZKYPMAVSRIREEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2S/c1-20-9-4-2-8(3-5-9)11-7-6-10-12(16)13(14(17)19)21-15(10)18-11/h2-7H,16H2,1H3,(H2,17,19).
What are the key properties of 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide?
3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 299.36 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 4778721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).