ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate

C12H15N3O4 — CID 54502475

IUPACethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate
SMILESCCOC(=O)n1nc2cc(OC)c(OC)cc2c1N
InChIInChI=1S/C12H15N3O4/c1-4-19-12(16)15-11(13)7-5-9(17-2)10(18-3)6-8(7)14-15/h5-6H,4,13H2,1-3H3
InChIKeyYDKDPCUQIWVJOV-UHFFFAOYSA-N
MW265.27 g/mol
LogP1.64
Rot. Bonds3

About ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate

ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate (PubChem CID 54502475) has the molecular formula C12H15N3O4 and a molecular weight of 265.27 g/mol. Its IUPAC name is ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate.

Molecular Properties

Compound Nameethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate
PubChem CID54502475
Molecular FormulaC12H15N3O4
Molecular Weight265.27 g/mol
Exact Mass265.11
IUPAC Nameethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate
SMILESCCOC(=O)n1nc2cc(OC)c(OC)cc2c1N
InChIInChI=1S/C12H15N3O4/c1-4-19-12(16)15-11(13)7-5-9(17-2)10(18-3)6-8(7)14-15/h5-6H,4,13H2,1-3H3
InChIKeyYDKDPCUQIWVJOV-UHFFFAOYSA-N
XLogP1.64
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze ethyl 3-amino-5,6-dimethoxyindazole-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

4-amino-3-(2-hydroxyethyl)-6,7-dimethoxyquinazoline-2-thione
CID 135142587
ethyl 4-chloro-6,7-dimethoxycinnoline-3-carboxylate
CID 67083777
ethyl 4-(5-amino-6-methoxybenzotriazol-2-yl)benzoate
CID 91676258
ethyl N-[1-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperidin-4-yl]-N-methylcarbamate
CID 3049505
ethyl 5-hydroxy-3-methoxyindazole-1-carboxylate
CID 156851175
ethyl 3-bromo-6,7-dimethoxyquinoxaline-2-carboxylate
CID 133060108
(1S)-1-(5,6-dimethoxybenzotriazol-2-yl)propan-1-amine
CID 70364748
ethyl 3-amino-7-(ethoxycarbonylamino)-5-(trifluoromethyl)indazole-2-carboxylate
CID 54395129
ethyl 4-(5-amino-6,7-dimethoxy-4-oxoquinazolin-3-yl)butanoate
CID 10735519
N-[(3-amino-5-methylphenyl)methyl]-2-(6,7-dimethoxy-4-oxoquinazolin-3-yl)acetamide
CID 166238740
4-amino-6,7-dimethoxyquinoline-2-carboxylic acid
CID 84632987
ethyl 4-ethyl-6,7-dimethoxynaphthalene-1-carboxylate
CID 141201124

Frequently Asked Questions

What is the IUPAC name of ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate?
The IUPAC name of ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate (CID 54502475) is ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate.
What is the SMILES notation for ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate?
The canonical SMILES for ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate is CCOC(=O)n1nc2cc(OC)c(OC)cc2c1N.
What is the InChIKey of ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate?
The InChIKey is YDKDPCUQIWVJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O4/c1-4-19-12(16)15-11(13)7-5-9(17-2)10(18-3)6-8(7)14-15/h5-6H,4,13H2,1-3H3.
What are the key properties of ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate?
ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate has a molecular weight of 265.27 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-amino-5,6-dimethoxyindazole-2-carboxylate is sourced from PubChem (CID 54502475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).