5-bromo-3-ethyl-4-methoxy-2H-indazole

C10H11BrN2O — CID 168932014

IUPAC5-bromo-3-ethyl-4-methoxy-2H-indazole
SMILESCCc1[nH]nc2ccc(Br)c(OC)c12
InChIInChI=1S/C10H11BrN2O/c1-3-7-9-8(13-12-7)5-4-6(11)10(9)14-2/h4-5H,3H2,1-2H3,(H,12,13)
InChIKeyMAUIUJSONTYBBR-UHFFFAOYSA-N
MW255.11 g/mol
LogP2.90
Rot. Bonds2

About 5-bromo-3-ethyl-4-methoxy-2H-indazole

5-bromo-3-ethyl-4-methoxy-2H-indazole (PubChem CID 168932014) has the molecular formula C10H11BrN2O and a molecular weight of 255.11 g/mol. Its IUPAC name is 5-bromo-3-ethyl-4-methoxy-2H-indazole.

Molecular Properties

Compound Name5-bromo-3-ethyl-4-methoxy-2H-indazole
PubChem CID168932014
Molecular FormulaC10H11BrN2O
Molecular Weight255.11 g/mol
Exact Mass254.01
IUPAC Name5-bromo-3-ethyl-4-methoxy-2H-indazole
SMILESCCc1[nH]nc2ccc(Br)c(OC)c12
InChIInChI=1S/C10H11BrN2O/c1-3-7-9-8(13-12-7)5-4-6(11)10(9)14-2/h4-5H,3H2,1-2H3,(H,12,13)
InChIKeyMAUIUJSONTYBBR-UHFFFAOYSA-N
XLogP2.90
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.11
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-4-methoxy-3-methyl-2H-indazole
CID 84702333
3-ethyl-4-methoxy-2H-indazole
CID 76846083
1,4-dibromo-2,3-dimethoxybenzene
CID 15784959
3-ethyl-2H-indazole-4-carbaldehyde
CID 105435762
4-methoxy-3-[2-(4-methylphenyl)ethyl]-2H-indazol-5-amine
CID 89206287
3-iodo-4-methoxy-2H-indazol-5-amine
CID 89206256
2-amino-6-bromo-5-methoxy-3H-quinazolin-4-one;trihydrate
CID 137314152
6-bromo-1-ethyl-7-methoxybenzotriazole
CID 168931968
2-(3-ethyl-2H-indazol-4-yl)acetic acid
CID 84672219
3-ethyl-5-propyl-2H-indazole
CID 88974501
3-ethyl-2H-indazole;molecular hydrogen
CID 156727025
1-(4-bromo-2,3-dimethoxyphenyl)-N-methoxymethanamine
CID 117441818

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-ethyl-4-methoxy-2H-indazole?
The IUPAC name of 5-bromo-3-ethyl-4-methoxy-2H-indazole (CID 168932014) is 5-bromo-3-ethyl-4-methoxy-2H-indazole.
What is the SMILES notation for 5-bromo-3-ethyl-4-methoxy-2H-indazole?
The canonical SMILES for 5-bromo-3-ethyl-4-methoxy-2H-indazole is CCc1[nH]nc2ccc(Br)c(OC)c12.
What is the InChIKey of 5-bromo-3-ethyl-4-methoxy-2H-indazole?
The InChIKey is MAUIUJSONTYBBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2O/c1-3-7-9-8(13-12-7)5-4-6(11)10(9)14-2/h4-5H,3H2,1-2H3,(H,12,13).
What are the key properties of 5-bromo-3-ethyl-4-methoxy-2H-indazole?
5-bromo-3-ethyl-4-methoxy-2H-indazole has a molecular weight of 255.11 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-ethyl-4-methoxy-2H-indazole is sourced from PubChem (CID 168932014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).