methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate

C18H19N3O3 — CID 149358041

IUPACmethyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate
SMILESCOCCn1nc(Cc2cnccc2C(=O)OC)c2ccccc21
InChIInChI=1S/C18H19N3O3/c1-23-10-9-21-17-6-4-3-5-15(17)16(20-21)11-13-12-19-8-7-14(13)18(22)24-2/h3-8,12H,9-11H2,1-2H3
InChIKeyYHISWYFXHXWWQD-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.46
Rot. Bonds6

About methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate

methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate (PubChem CID 149358041) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate
PubChem CID149358041
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Namemethyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate
SMILESCOCCn1nc(Cc2cnccc2C(=O)OC)c2ccccc21
InChIInChI=1S/C18H19N3O3/c1-23-10-9-21-17-6-4-3-5-15(17)16(20-21)11-13-12-19-8-7-14(13)18(22)24-2/h3-8,12H,9-11H2,1-2H3
InChIKeyYHISWYFXHXWWQD-UHFFFAOYSA-N
XLogP2.46
TPSA66.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]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-[(1-propylindazol-3-yl)amino]pyridine-4-carboxylate
CID 90216554
methyl 3-[(1-cyclopentyl-5-fluoroindazol-3-yl)methyl]pyridine-4-carboxylate
CID 148583128
methyl 1-(3-methoxypropyl)indazole-3-carboxylate
CID 68501253
methyl 2-[[3-(2-methoxyethyl)-4-oxophthalazin-1-yl]methylcarbamoyl]benzoate
CID 121048641
1-[1-[2-(3-methoxypropoxy)ethyl]indazol-3-yl]-N-methylmethanamine
CID 103184311
3-[[1-(4,4-dimethylpentyl)-5-fluoroindazol-3-yl]methyl]pyridine-4-carboxylic acid
CID 157145511
N-[[3-(2-methoxyethyl)-4-oxophthalazin-1-yl]methyl]-2-methylpropanamide
CID 121048510
[1-(2-methoxyethyl)indazol-3-yl]-(2-nitrophenyl)methanone
CID 170857621
N-[(1-ethylindazol-3-yl)methyl]pyrazine-2-carboxamide
CID 53163992
N-[(1-ethylindazol-3-yl)methyl]-1-(4-methyl-3-pyridinyl)methanamine
CID 114955473
methyl 3-bromopyridine-4-carboxylate;methyl 3-[(1-methyl-3-phenylpyrazol-5-yl)methyl]pyridine-4-carboxylate;1-methyl-3-phenylpyrazol-5-amine;3-[(1-methyl-3-phenylpyrazol-5-yl)methyl]pyridine-4-carboxylic acid
CID 159486109
1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide
CID 71701698

Frequently Asked Questions

What is the IUPAC name of methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate?
The IUPAC name of methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate (CID 149358041) is methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate.
What is the SMILES notation for methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate?
The canonical SMILES for methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate is COCCn1nc(Cc2cnccc2C(=O)OC)c2ccccc21.
What is the InChIKey of methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate?
The InChIKey is YHISWYFXHXWWQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-23-10-9-21-17-6-4-3-5-15(17)16(20-21)11-13-12-19-8-7-14(13)18(22)24-2/h3-8,12H,9-11H2,1-2H3.
What are the key properties of methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate?
methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate has a molecular weight of 325.37 g/mol, XLogP of 2.46, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-[[1-(2-methoxyethyl)indazol-3-yl]methyl]pyridine-4-carboxylate is sourced from PubChem (CID 149358041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).