ethane;6-methoxy-1H-indazole

C10H14N2O — CID 144719676

IUPACethane;6-methoxy-1H-indazole
SMILESCC.COc1ccc2cn[nH]c2c1
InChIInChI=1S/C8H8N2O.C2H6/c1-11-7-3-2-6-5-9-10-8(6)4-7;1-2/h2-5H,1H3,(H,9,10);1-2H3
InChIKeyQMHJMJPABHFXHV-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.60
Rot. Bonds1

About ethane;6-methoxy-1H-indazole

ethane;6-methoxy-1H-indazole (PubChem CID 144719676) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is ethane;6-methoxy-1H-indazole.

Molecular Properties

Compound Nameethane;6-methoxy-1H-indazole
PubChem CID144719676
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Nameethane;6-methoxy-1H-indazole
SMILESCC.COc1ccc2cn[nH]c2c1
InChIInChI=1S/C8H8N2O.C2H6/c1-11-7-3-2-6-5-9-10-8(6)4-7;1-2/h2-5H,1H3,(H,9,10);1-2H3
InChIKeyQMHJMJPABHFXHV-UHFFFAOYSA-N
XLogP2.60
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1H-indazol-6-yl)-3-(4-methoxyphenyl)urea
CID 108866360
5-(4-methoxyphenoxy)-1H-indazole
CID 22349444
6-pyridin-4-yloxy-1H-indazole
CID 163366641
6-pyridin-3-yloxy-1H-indazole
CID 118649525
N-[(4-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
CID 46341632
6-(cyclopropylmethoxy)-1H-indazole
CID 67778171
ethene;6-methyl-1H-indazole
CID 123213038
6-methyl-1H-indazole;molecular hydrogen
CID 142103069
N-(1H-indazol-6-yl)-2-(3-methoxyphenyl)acetamide
CID 36561093
6-[5-(3-methoxyphenyl)pyrazol-1-yl]-1H-indazole
CID 70981884
6-N-(2-chloro-5-methoxyphenyl)-1H-indazole-5,6-diamine
CID 107489707
8-methoxy-3H-pyrazolo[3,4-c]quinoline
CID 141354745

Frequently Asked Questions

What is the IUPAC name of ethane;6-methoxy-1H-indazole?
The IUPAC name of ethane;6-methoxy-1H-indazole (CID 144719676) is ethane;6-methoxy-1H-indazole.
What is the SMILES notation for ethane;6-methoxy-1H-indazole?
The canonical SMILES for ethane;6-methoxy-1H-indazole is CC.COc1ccc2cn[nH]c2c1.
What is the InChIKey of ethane;6-methoxy-1H-indazole?
The InChIKey is QMHJMJPABHFXHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O.C2H6/c1-11-7-3-2-6-5-9-10-8(6)4-7;1-2/h2-5H,1H3,(H,9,10);1-2H3.
What are the key properties of ethane;6-methoxy-1H-indazole?
ethane;6-methoxy-1H-indazole has a molecular weight of 178.23 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methoxy-1H-indazole is sourced from PubChem (CID 144719676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).