7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide

C8H6BrN3OS — CID 76852960

IUPAC7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide
SMILESNC(=O)c1cc2c(Br)cnc(N)c2s1
InChIInChI=1S/C8H6BrN3OS/c9-4-2-12-7(10)6-3(4)1-5(14-6)8(11)13/h1-2H,(H2,10,12)(H2,11,13)
InChIKeyHQYRXXHTMINEEO-UHFFFAOYSA-N
MW272.13 g/mol
LogP1.74
Rot. Bonds1

About 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide

7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide (PubChem CID 76852960) has the molecular formula C8H6BrN3OS and a molecular weight of 272.13 g/mol. Its IUPAC name is 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide
PubChem CID76852960
Molecular FormulaC8H6BrN3OS
Molecular Weight272.13 g/mol
Exact Mass270.94
IUPAC Name7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide
SMILESNC(=O)c1cc2c(Br)cnc(N)c2s1
InChIInChI=1S/C8H6BrN3OS/c9-4-2-12-7(10)6-3(4)1-5(14-6)8(11)13/h1-2H,(H2,10,12)(H2,11,13)
InChIKeyHQYRXXHTMINEEO-UHFFFAOYSA-N
XLogP1.74
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.13
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide (CID 76852960) is 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide is NC(=O)c1cc2c(Br)cnc(N)c2s1.
What is the InChIKey of 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide?
The InChIKey is HQYRXXHTMINEEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6BrN3OS/c9-4-2-12-7(10)6-3(4)1-5(14-6)8(11)13/h1-2H,(H2,10,12)(H2,11,13).
What are the key properties of 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide?
7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide has a molecular weight of 272.13 g/mol, XLogP of 1.74, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-4-bromothieno[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 76852960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).