6-methoxy-1-methyl-2H-pyridine-3-carboxamide

C8H12N2O2 — CID 137348763

IUPAC6-methoxy-1-methyl-2H-pyridine-3-carboxamide
SMILESCOC1=CC=C(C(N)=O)CN1C
InChIInChI=1S/C8H12N2O2/c1-10-5-6(8(9)11)3-4-7(10)12-2/h3-4H,5H2,1-2H3,(H2,9,11)
InChIKeyXDTUJYQFSMEIJT-UHFFFAOYSA-N
MW168.20 g/mol
LogP-0.17
Rot. Bonds2

About 6-methoxy-1-methyl-2H-pyridine-3-carboxamide

6-methoxy-1-methyl-2H-pyridine-3-carboxamide (PubChem CID 137348763) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 6-methoxy-1-methyl-2H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-1-methyl-2H-pyridine-3-carboxamide
PubChem CID137348763
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name6-methoxy-1-methyl-2H-pyridine-3-carboxamide
SMILESCOC1=CC=C(C(N)=O)CN1C
InChIInChI=1S/C8H12N2O2/c1-10-5-6(8(9)11)3-4-7(10)12-2/h3-4H,5H2,1-2H3,(H2,9,11)
InChIKeyXDTUJYQFSMEIJT-UHFFFAOYSA-N
XLogP-0.17
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-1-methyl-2H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1-methyl-2H-pyridine-3-carboxamide?
The IUPAC name of 6-methoxy-1-methyl-2H-pyridine-3-carboxamide (CID 137348763) is 6-methoxy-1-methyl-2H-pyridine-3-carboxamide.
What is the SMILES notation for 6-methoxy-1-methyl-2H-pyridine-3-carboxamide?
The canonical SMILES for 6-methoxy-1-methyl-2H-pyridine-3-carboxamide is COC1=CC=C(C(N)=O)CN1C.
What is the InChIKey of 6-methoxy-1-methyl-2H-pyridine-3-carboxamide?
The InChIKey is XDTUJYQFSMEIJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-10-5-6(8(9)11)3-4-7(10)12-2/h3-4H,5H2,1-2H3,(H2,9,11).
What are the key properties of 6-methoxy-1-methyl-2H-pyridine-3-carboxamide?
6-methoxy-1-methyl-2H-pyridine-3-carboxamide has a molecular weight of 168.20 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1-methyl-2H-pyridine-3-carboxamide is sourced from PubChem (CID 137348763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).