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

C10H12N4OS — CID 759785

IUPAC3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide
SMILESCN(C)c1ccnc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C10H12N4OS/c1-14(2)5-3-4-13-10-6(5)7(11)8(16-10)9(12)15/h3-4H,11H2,1-2H3,(H2,12,15)
InChIKeyAPQCIRNWAACMSD-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.04
Rot. Bonds2

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

3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 759785) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID759785
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide
SMILESCN(C)c1ccnc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C10H12N4OS/c1-14(2)5-3-4-13-10-6(5)7(11)8(16-10)9(12)15/h3-4H,11H2,1-2H3,(H2,12,15)
InChIKeyAPQCIRNWAACMSD-UHFFFAOYSA-N
XLogP1.04
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide (CID 759785) is 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide is CN(C)c1ccnc2sc(C(N)=O)c(N)c12.
What is the InChIKey of 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is APQCIRNWAACMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-14(2)5-3-4-13-10-6(5)7(11)8(16-10)9(12)15/h3-4H,11H2,1-2H3,(H2,12,15).
What are the key properties of 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide?
3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 236.30 g/mol, XLogP of 1.04, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 759785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).