7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide

C10H9BrN2O2S — CID 122582253

IUPAC7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide
SMILESCON(C)C(=O)c1cc2cncc(Br)c2s1
InChIInChI=1S/C10H9BrN2O2S/c1-13(15-2)10(14)8-3-6-4-12-5-7(11)9(6)16-8/h3-5H,1-2H3
InChIKeyKKNMLPQIFVQJFQ-UHFFFAOYSA-N
MW301.17 g/mol
LogP2.69
Rot. Bonds2

About 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide

7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide (PubChem CID 122582253) has the molecular formula C10H9BrN2O2S and a molecular weight of 301.17 g/mol. Its IUPAC name is 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide
PubChem CID122582253
Molecular FormulaC10H9BrN2O2S
Molecular Weight301.17 g/mol
Exact Mass299.96
IUPAC Name7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide
SMILESCON(C)C(=O)c1cc2cncc(Br)c2s1
InChIInChI=1S/C10H9BrN2O2S/c1-13(15-2)10(14)8-3-6-4-12-5-7(11)9(6)16-8/h3-5H,1-2H3
InChIKeyKKNMLPQIFVQJFQ-UHFFFAOYSA-N
XLogP2.69
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.17
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-p-Tolylsulfanyl-thieno[2,3-c]pyridine-2-carboxylic acid methoxy-amide
CID 9797597
4-p-Tolylsulfanyl-thieno[2,3-c]pyridine-2-carboxylic acid methoxy-methyl-amide
CID 9798233
4-(4-Bromophenyl)sulfanylthieno[2,3-c]pyridine-2-carboxamide
CID 9947244
4-(4-Bromophenyl)thieno[2,3-c]pyridine-2-carboxamide
CID 18516106
5-bromo-N'-(5-ethyl-4-methylthiophene-2-carbonyl)pyridine-3-carbohydrazide
CID 4789693
Methyl 7-bromothieno[3,2-c]pyridine-2-carboxylate
CID 139023950
(5-Bromothieno[2,3-b]pyridin-2-yl)-(3,3-difluorocyclobutyl)methanone
CID 172542137
5-bromo-N-[(5-ethylthiophen-2-yl)methyl]pyridine-3-carboxamide
CID 40168463
4-bromo-5-ethyl-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide
CID 1245799
4-bromo-5-ethyl-N-(pyridin-4-ylmethyl)thiophene-2-carboxamide
CID 4500732
4-Bromothieno[2,3-c]pyridine-2-carboxamide
CID 18516274
N-methoxythieno[3,2-c]pyridine-2-carboxamide
CID 20244339

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide?
The IUPAC name of 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide (CID 122582253) is 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide.
What is the SMILES notation for 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide?
The canonical SMILES for 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide is CON(C)C(=O)c1cc2cncc(Br)c2s1.
What is the InChIKey of 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide?
The InChIKey is KKNMLPQIFVQJFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2O2S/c1-13(15-2)10(14)8-3-6-4-12-5-7(11)9(6)16-8/h3-5H,1-2H3.
What are the key properties of 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide?
7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide has a molecular weight of 301.17 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-methoxy-N-methylthieno[3,2-c]pyridine-2-carboxamide is sourced from PubChem (CID 122582253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).