ethyl 2-indazol-1-ylpyridine-3-carboxylate

C15H13N3O2 — CID 66720157

IUPACethyl 2-indazol-1-ylpyridine-3-carboxylate
SMILESCCOC(=O)c1cccnc1-n1ncc2ccccc21
InChIInChI=1S/C15H13N3O2/c1-2-20-15(19)12-7-5-9-16-14(12)18-13-8-4-3-6-11(13)10-17-18/h3-10H,2H2,1H3
InChIKeyONDNAVNTJZQMDR-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.60
Rot. Bonds3

About ethyl 2-indazol-1-ylpyridine-3-carboxylate

ethyl 2-indazol-1-ylpyridine-3-carboxylate (PubChem CID 66720157) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is ethyl 2-indazol-1-ylpyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-indazol-1-ylpyridine-3-carboxylate
PubChem CID66720157
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Nameethyl 2-indazol-1-ylpyridine-3-carboxylate
SMILESCCOC(=O)c1cccnc1-n1ncc2ccccc21
InChIInChI=1S/C15H13N3O2/c1-2-20-15(19)12-7-5-9-16-14(12)18-13-8-4-3-6-11(13)10-17-18/h3-10H,2H2,1H3
InChIKeyONDNAVNTJZQMDR-UHFFFAOYSA-N
XLogP2.60
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2-indazol-1-yl-3-pyridinyl)methanol
CID 62140582
ethyl 2-pyrazolo[5,4-b]pyridin-1-ylpyrazolo[5,1-b][1,3]thiazole-7-carboxylate
CID 164548277
ethyl 1,6-naphthyridine-8-carboxylate
CID 141265974
ethyl 2-(4-ethoxycarbonylpiperidin-1-yl)pyridine-3-carboxylate
CID 71741541
1-(3-ethoxycarbonyl-2-pyridinyl)imidazole-4-carboxylic acid
CID 63343432
ethyl 2-ethynylpyridine-3-carboxylate
CID 54287317
ethyl 2-phenylpyridine-3-carboxylate
CID 10846916
ethyl 5-chloro-1-pyrimidin-2-ylpyrazole-4-carboxylate
CID 19839439
ethyl 2-(3-fluoropyrrolidin-1-yl)pyridine-3-carboxylate
CID 123284983
2-(2-indazol-1-ylphenyl)pyridine-3-carboxamide
CID 174764256
ethyl 2-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]pyridine-3-carboxylate
CID 99617166
ethyl 2-(4-anilinopiperidin-1-yl)pyridine-3-carboxylate
CID 133468930

Frequently Asked Questions

What is the IUPAC name of ethyl 2-indazol-1-ylpyridine-3-carboxylate?
The IUPAC name of ethyl 2-indazol-1-ylpyridine-3-carboxylate (CID 66720157) is ethyl 2-indazol-1-ylpyridine-3-carboxylate.
What is the SMILES notation for ethyl 2-indazol-1-ylpyridine-3-carboxylate?
The canonical SMILES for ethyl 2-indazol-1-ylpyridine-3-carboxylate is CCOC(=O)c1cccnc1-n1ncc2ccccc21.
What is the InChIKey of ethyl 2-indazol-1-ylpyridine-3-carboxylate?
The InChIKey is ONDNAVNTJZQMDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-2-20-15(19)12-7-5-9-16-14(12)18-13-8-4-3-6-11(13)10-17-18/h3-10H,2H2,1H3.
What are the key properties of ethyl 2-indazol-1-ylpyridine-3-carboxylate?
ethyl 2-indazol-1-ylpyridine-3-carboxylate has a molecular weight of 267.29 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-indazol-1-ylpyridine-3-carboxylate is sourced from PubChem (CID 66720157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).