6-(cyclopropylmethoxy)-1H-indazole

C11H12N2O — CID 67778171

IUPAC6-(cyclopropylmethoxy)-1H-indazole
SMILESc1cc2cn[nH]c2cc1OCC1CC1
InChIInChI=1S/C11H12N2O/c1-2-8(1)7-14-10-4-3-9-6-12-13-11(9)5-10/h3-6,8H,1-2,7H2,(H,12,13)
InChIKeyMSGADEOGGBDRGJ-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.35
Rot. Bonds3

About 6-(cyclopropylmethoxy)-1H-indazole

6-(cyclopropylmethoxy)-1H-indazole (PubChem CID 67778171) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-1H-indazole.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-1H-indazole
PubChem CID67778171
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name6-(cyclopropylmethoxy)-1H-indazole
SMILESc1cc2cn[nH]c2cc1OCC1CC1
InChIInChI=1S/C11H12N2O/c1-2-8(1)7-14-10-4-3-9-6-12-13-11(9)5-10/h3-6,8H,1-2,7H2,(H,12,13)
InChIKeyMSGADEOGGBDRGJ-UHFFFAOYSA-N
XLogP2.35
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-1H-indazole?
The IUPAC name of 6-(cyclopropylmethoxy)-1H-indazole (CID 67778171) is 6-(cyclopropylmethoxy)-1H-indazole.
What is the SMILES notation for 6-(cyclopropylmethoxy)-1H-indazole?
The canonical SMILES for 6-(cyclopropylmethoxy)-1H-indazole is c1cc2cn[nH]c2cc1OCC1CC1.
What is the InChIKey of 6-(cyclopropylmethoxy)-1H-indazole?
The InChIKey is MSGADEOGGBDRGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-2-8(1)7-14-10-4-3-9-6-12-13-11(9)5-10/h3-6,8H,1-2,7H2,(H,12,13).
What are the key properties of 6-(cyclopropylmethoxy)-1H-indazole?
6-(cyclopropylmethoxy)-1H-indazole has a molecular weight of 188.23 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-1H-indazole is sourced from PubChem (CID 67778171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).