5-bromo-2-methoxy-N-methylpyridine-3-carboxamide

C8H9BrN2O2 — CID 25114918

IUPAC5-bromo-2-methoxy-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1cc(Br)cnc1OC
InChIInChI=1S/C8H9BrN2O2/c1-10-7(12)6-3-5(9)4-11-8(6)13-2/h3-4H,1-2H3,(H,10,12)
InChIKeyMUAARLCXQTWPPF-UHFFFAOYSA-N
MW245.08 g/mol
LogP1.21
Rot. Bonds2

About 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide

5-bromo-2-methoxy-N-methylpyridine-3-carboxamide (PubChem CID 25114918) has the molecular formula C8H9BrN2O2 and a molecular weight of 245.08 g/mol. Its IUPAC name is 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-2-methoxy-N-methylpyridine-3-carboxamide
PubChem CID25114918
Molecular FormulaC8H9BrN2O2
Molecular Weight245.08 g/mol
Exact Mass243.98
IUPAC Name5-bromo-2-methoxy-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1cc(Br)cnc1OC
InChIInChI=1S/C8H9BrN2O2/c1-10-7(12)6-3-5(9)4-11-8(6)13-2/h3-4H,1-2H3,(H,10,12)
InChIKeyMUAARLCXQTWPPF-UHFFFAOYSA-N
XLogP1.21
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.08
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-hydroxy-2-methoxy-N-methylpyridine-3-carboxamide
CID 164765730
5-bromo-2-methoxypyridine-3-carboxamide
CID 70281718
5-bromo-2-fluoro-N-methylpyridine-3-carboxamide
CID 74890483
3-(5-bromo-2-methoxy-3-pyridinyl)-3-oxopropanenitrile;methyl 5-bromo-2-methoxypyridine-3-carboxylate
CID 158631727
(3R,4S)-3-[(5-bromo-2-methoxypyridine-3-carbonyl)amino]-4-fluoropyrrolidine-1-carboxylic acid
CID 139349031
azane;N-(5-bromo-2-methoxy-3-pyridinyl)methanesulfonamide
CID 175114352
5-(4-amino-2,6-dichlorophenoxy)-2-methoxy-N-methylpyridine-3-carboxamide
CID 163293534
ethyl 2-[4-[2-[(5-bromo-2-methoxypyridine-3-carbonyl)amino]ethyl]phenyl]acetate
CID 23453094
dimethyl 5-bromopyridine-2,3-dicarboxylate
CID 53423993
N-(5-bromo-2-methoxy-3-pyridinyl)propanamide
CID 71304513
methyl 3-(5-bromo-2-methoxy-3-pyridinyl)prop-2-enoate
CID 138114377
5-bromo-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carboxylic acid
CID 104560416

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide?
The IUPAC name of 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide (CID 25114918) is 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide?
The canonical SMILES for 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide is CNC(=O)c1cc(Br)cnc1OC.
What is the InChIKey of 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide?
The InChIKey is MUAARLCXQTWPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrN2O2/c1-10-7(12)6-3-5(9)4-11-8(6)13-2/h3-4H,1-2H3,(H,10,12).
What are the key properties of 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide?
5-bromo-2-methoxy-N-methylpyridine-3-carboxamide has a molecular weight of 245.08 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-methoxy-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 25114918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).