methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate

C10H10N4O3 — CID 175978217

IUPACmethyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate
SMILESCOC(=O)c1ccnc(OC)c1-n1nccn1
InChIInChI=1S/C10H10N4O3/c1-16-9-8(14-12-5-6-13-14)7(3-4-11-9)10(15)17-2/h3-6H,1-2H3
InChIKeyUTFIUFKEWPIYPB-UHFFFAOYSA-N
MW234.22 g/mol
LogP0.46
Rot. Bonds3

About methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate

methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate (PubChem CID 175978217) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate
PubChem CID175978217
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC Namemethyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate
SMILESCOC(=O)c1ccnc(OC)c1-n1nccn1
InChIInChI=1S/C10H10N4O3/c1-16-9-8(14-12-5-6-13-14)7(3-4-11-9)10(15)17-2/h3-6H,1-2H3
InChIKeyUTFIUFKEWPIYPB-UHFFFAOYSA-N
XLogP0.46
TPSA79.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 50.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate with MolForge

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

Launch Full Analysis

Related Compounds

methyl 3-bromo-2-methoxypyridine-4-carboxylate
CID 46311220
methyl 2-(2-methoxypyridine-3-carbonyl)benzoate
CID 24723742
methyl 2-fluoro-3-methylpyridine-4-carboxylate
CID 118989256
methyl 3-bromo-2H-pyrazolo[3,4-b]pyridine-4-carboxylate
CID 131552131
methyl imidazo[1,2-b]pyridazine-8-carboxylate
CID 141364137
methyl 3-methyl-1H-pyrrolo[2,3-b]pyridine-4-carboxylate
CID 124705864
methyl 3-hydroxy-2-iodopyridine-4-carboxylate
CID 167511597
methyl 3-amino-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine-4-carboxylate
CID 112588507
tetramethyl naphthalene-1,4,5,8-tetracarboxylate
CID 520552
methyl 3-iodo-2H-pyrazolo[4,3-b]pyridine-7-carboxylate
CID 162342553
methyl 6,7-dimethoxyquinoline-4-carboxylate
CID 59756874
di(113C)methyl benzene-1,2-dicarboxylate
CID 131668060

Frequently Asked Questions

What is the IUPAC name of methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate?
The IUPAC name of methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate (CID 175978217) is methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate.
What is the SMILES notation for methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate?
The canonical SMILES for methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate is COC(=O)c1ccnc(OC)c1-n1nccn1.
What is the InChIKey of methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate?
The InChIKey is UTFIUFKEWPIYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c1-16-9-8(14-12-5-6-13-14)7(3-4-11-9)10(15)17-2/h3-6H,1-2H3.
What are the key properties of methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate?
methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate has a molecular weight of 234.22 g/mol, XLogP of 0.46, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methoxy-3-(triazol-2-yl)pyridine-4-carboxylate is sourced from PubChem (CID 175978217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).