1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol

C14H20N2O3 — CID 106989379

IUPAC1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol
SMILESCOCC(C)OCC(O)Cn1ncc2ccccc21
InChIInChI=1S/C14H20N2O3/c1-11(9-18-2)19-10-13(17)8-16-14-6-4-3-5-12(14)7-15-16/h3-7,11,13,17H,8-10H2,1-2H3
InChIKeyQRSUZWGRXXPTAA-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.45
Rot. Bonds7

About 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol

1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol (PubChem CID 106989379) has the molecular formula C14H20N2O3 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol.

Molecular Properties

Compound Name1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol
PubChem CID106989379
Molecular FormulaC14H20N2O3
Molecular Weight264.33 g/mol
Exact Mass264.15
IUPAC Name1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol
SMILESCOCC(C)OCC(O)Cn1ncc2ccccc21
InChIInChI=1S/C14H20N2O3/c1-11(9-18-2)19-10-13(17)8-16-14-6-4-3-5-12(14)7-15-16/h3-7,11,13,17H,8-10H2,1-2H3
InChIKeyQRSUZWGRXXPTAA-UHFFFAOYSA-N
XLogP1.45
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1,3-dihydroisoindol-2-yl)-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991981
1-indazol-1-yl-3,3-dimethylbutan-2-ol
CID 62141901
1-[(2R)-3-chloro-2-methylpropyl]indazole
CID 118871643
N-(2-hydroxy-3-methoxypropyl)-2-indazol-1-yl-N-methylacetamide
CID 71864031
1-(1-methoxypropan-2-yloxy)-3-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)propan-2-ol
CID 106992102
1-methoxy-3-(6-nitroindazol-1-yl)propan-2-ol
CID 63930886
1-(4,5-dimethylimidazol-1-yl)-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106989388
methyl (2R)-2-[(2-indazol-1-ylacetyl)amino]-3-methoxypropanoate
CID 97260617
1-(1-methoxypropan-2-yloxy)-3-[4-(trifluoromethyl)pyrazol-1-yl]propan-2-ol
CID 106989455
1-methoxy-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 107508429
1-(3,4-dihydro-2H-quinolin-1-yl)-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991698
1-amino-4-indazol-1-ylbutan-2-ol
CID 64820572

Frequently Asked Questions

What is the IUPAC name of 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol?
The IUPAC name of 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol (CID 106989379) is 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol.
What is the SMILES notation for 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol?
The canonical SMILES for 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol is COCC(C)OCC(O)Cn1ncc2ccccc21.
What is the InChIKey of 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol?
The InChIKey is QRSUZWGRXXPTAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-11(9-18-2)19-10-13(17)8-16-14-6-4-3-5-12(14)7-15-16/h3-7,11,13,17H,8-10H2,1-2H3.
What are the key properties of 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol?
1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol has a molecular weight of 264.33 g/mol, XLogP of 1.45, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-indazol-1-yl-3-(1-methoxypropan-2-yloxy)propan-2-ol is sourced from PubChem (CID 106989379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).