3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide

C12H15N3O2 — CID 68707947

IUPAC3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide
SMILESCCc1[nH]nc2cc(C(=O)NCOC)ccc12
InChIInChI=1S/C12H15N3O2/c1-3-10-9-5-4-8(6-11(9)15-14-10)12(16)13-7-17-2/h4-6H,3,7H2,1-2H3,(H,13,16)(H,14,15)
InChIKeyWMMWKYAGBPIJLU-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.46
Rot. Bonds4

About 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide

3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide (PubChem CID 68707947) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide
PubChem CID68707947
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide
SMILESCCc1[nH]nc2cc(C(=O)NCOC)ccc12
InChIInChI=1S/C12H15N3O2/c1-3-10-9-5-4-8(6-11(9)15-14-10)12(16)13-7-17-2/h4-6H,3,7H2,1-2H3,(H,13,16)(H,14,15)
InChIKeyWMMWKYAGBPIJLU-UHFFFAOYSA-N
XLogP1.46
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-ethyl-N-(2-methoxy-1-phenylethyl)-2H-indazole-5-carboxamide
CID 123173183
3-ethyl-N-[1-(3-methoxyphenyl)propyl]-2H-indazole-5-carboxamide
CID 123846554
N-ethyl-3-methyl-2H-indazole-5-carboxamide
CID 58243589
methyl 3-methyl-2H-indazole-6-carboxylate
CID 22387979
N-(methoxymethyl)-2-methyl-1,3-benzothiazole-6-carboxamide
CID 68765772
1-(cyclopropylmethyl)-3-ethyl-N-(methoxymethyl)indazole-6-carboxamide
CID 68710206
N-(methoxymethyl)-1H-pyrazole-4-carboxamide
CID 154047785
N-(3-ethyl-2H-indazol-5-yl)thiophene-3-carboxamide
CID 123969641
3-ethyl-2H-indazole;molecular hydrogen
CID 156727025
6-(2,6-difluoro-3,5-dimethoxyphenyl)-3-ethyl-2H-indazole
CID 166774565
ethyl 3-chloro-2H-indazole-6-carboxylate
CID 131699852
N-(methoxymethyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 86810517

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide?
The IUPAC name of 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide (CID 68707947) is 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide.
What is the SMILES notation for 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide?
The canonical SMILES for 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide is CCc1[nH]nc2cc(C(=O)NCOC)ccc12.
What is the InChIKey of 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide?
The InChIKey is WMMWKYAGBPIJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-3-10-9-5-4-8(6-11(9)15-14-10)12(16)13-7-17-2/h4-6H,3,7H2,1-2H3,(H,13,16)(H,14,15).
What are the key properties of 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide?
3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide has a molecular weight of 233.27 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(methoxymethyl)-2H-indazole-6-carboxamide is sourced from PubChem (CID 68707947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).