methyl 5-methoxy-1H-indazole-6-carboxylate

C10H10N2O3 — CID 76846397

IUPACmethyl 5-methoxy-1H-indazole-6-carboxylate
SMILESCOC(=O)c1cc2[nH]ncc2cc1OC
InChIInChI=1S/C10H10N2O3/c1-14-9-3-6-5-11-12-8(6)4-7(9)10(13)15-2/h3-5H,1-2H3,(H,11,12)
InChIKeyLZHXOVPQLNXMON-UHFFFAOYSA-N
MW206.20 g/mol
LogP1.36
Rot. Bonds2

About methyl 5-methoxy-1H-indazole-6-carboxylate

methyl 5-methoxy-1H-indazole-6-carboxylate (PubChem CID 76846397) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is methyl 5-methoxy-1H-indazole-6-carboxylate.

Molecular Properties

Compound Namemethyl 5-methoxy-1H-indazole-6-carboxylate
PubChem CID76846397
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Namemethyl 5-methoxy-1H-indazole-6-carboxylate
SMILESCOC(=O)c1cc2[nH]ncc2cc1OC
InChIInChI=1S/C10H10N2O3/c1-14-9-3-6-5-11-12-8(6)4-7(9)10(13)15-2/h3-5H,1-2H3,(H,11,12)
InChIKeyLZHXOVPQLNXMON-UHFFFAOYSA-N
XLogP1.36
TPSA64.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 6-methoxy-1H-indazole-5-carboxylate
CID 131750256
methyl 6-propan-2-yloxy-1H-indazole-5-carboxylate
CID 167136916
2-cyclohexylethanol;methyl 6-methoxy-1H-indazole-5-carboxylate
CID 177065402
(5-methoxy-1H-indazol-6-yl)boronic acid
CID 99942155
N-(1H-indazol-5-yl)-2,4,5-trimethoxybenzamide
CID 6468296
6-methoxy-N-methyl-1H-indazol-5-amine
CID 153364692
dimethyl 6,7-dimethoxynaphthalene-2,3-dicarboxylate
CID 10494700
2,6-dimethoxy-N-(5-methyl-1H-indazol-6-yl)benzamide
CID 154835907
tert-butyl-(6-methoxy-1H-indazol-5-yl)carbamic acid
CID 118173158
methyl 4-amino-5-bromo-1H-indazole-6-carboxylate
CID 142345968
CID 176998352
CID 176998352
methyl 4,5-diiodo-2-methoxybenzoate
CID 130877100

Frequently Asked Questions

What is the IUPAC name of methyl 5-methoxy-1H-indazole-6-carboxylate?
The IUPAC name of methyl 5-methoxy-1H-indazole-6-carboxylate (CID 76846397) is methyl 5-methoxy-1H-indazole-6-carboxylate.
What is the SMILES notation for methyl 5-methoxy-1H-indazole-6-carboxylate?
The canonical SMILES for methyl 5-methoxy-1H-indazole-6-carboxylate is COC(=O)c1cc2[nH]ncc2cc1OC.
What is the InChIKey of methyl 5-methoxy-1H-indazole-6-carboxylate?
The InChIKey is LZHXOVPQLNXMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c1-14-9-3-6-5-11-12-8(6)4-7(9)10(13)15-2/h3-5H,1-2H3,(H,11,12).
What are the key properties of methyl 5-methoxy-1H-indazole-6-carboxylate?
methyl 5-methoxy-1H-indazole-6-carboxylate has a molecular weight of 206.20 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-methoxy-1H-indazole-6-carboxylate is sourced from PubChem (CID 76846397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).