ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate

C10H11N3O2 — CID 63723819

IUPACethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate
SMILESCCOC(=O)c1nc2nccc(C)c2[nH]1
InChIInChI=1S/C10H11N3O2/c1-3-15-10(14)9-12-7-6(2)4-5-11-8(7)13-9/h4-5H,3H2,1-2H3,(H,11,12,13)
InChIKeyYROSTIKGIHWXNS-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.44
Rot. Bonds2

About ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate

ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate (PubChem CID 63723819) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate.

Molecular Properties

Compound Nameethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate
PubChem CID63723819
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Nameethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate
SMILESCCOC(=O)c1nc2nccc(C)c2[nH]1
InChIInChI=1S/C10H11N3O2/c1-3-15-10(14)9-12-7-6(2)4-5-11-8(7)13-9/h4-5H,3H2,1-2H3,(H,11,12,13)
InChIKeyYROSTIKGIHWXNS-UHFFFAOYSA-N
XLogP1.44
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-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

ethyl 2-ethyl-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)butanoate
CID 79471499
ethyl 1-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylate
CID 79471338
ethyl 4-chloro-1H-imidazo[4,5-c]pyridine-2-carboxylate
CID 131257762
N-methyl-1-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methanamine
CID 63724851
ethyl 6-(benzylamino)-7H-purine-8-carboxylate
CID 89439448
4-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]aniline
CID 55230387
1,1,1-trifluoro-3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-2-one
CID 79872278
2-[(4-ethylphenoxy)methyl]-7-methyl-1H-imidazo[4,5-b]pyridine
CID 82337401
1-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine
CID 63722977
2-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]phenol
CID 80741042
ethyl 6-amino-2-propyl-7H-purine-8-carboxylate
CID 174695877
3-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]phenol
CID 55228667

Frequently Asked Questions

What is the IUPAC name of ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate?
The IUPAC name of ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate (CID 63723819) is ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate.
What is the SMILES notation for ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate?
The canonical SMILES for ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate is CCOC(=O)c1nc2nccc(C)c2[nH]1.
What is the InChIKey of ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate?
The InChIKey is YROSTIKGIHWXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-3-15-10(14)9-12-7-6(2)4-5-11-8(7)13-9/h4-5H,3H2,1-2H3,(H,11,12,13).
What are the key properties of ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate?
ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate has a molecular weight of 205.22 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 7-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylate is sourced from PubChem (CID 63723819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).