1-(2-aminoethyl)indazol-6-ol

C9H11N3O — CID 135520431

IUPAC1-(2-aminoethyl)indazol-6-ol
SMILESNCCn1ncc2ccc(O)cc21
InChIInChI=1S/C9H11N3O/c10-3-4-12-9-5-8(13)2-1-7(9)6-11-12/h1-2,5-6,13H,3-4,10H2
InChIKeyRVQKKYXTHSVLLB-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.70
Rot. Bonds2

About 1-(2-aminoethyl)indazol-6-ol

1-(2-aminoethyl)indazol-6-ol (PubChem CID 135520431) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 1-(2-aminoethyl)indazol-6-ol.

Molecular Properties

Compound Name1-(2-aminoethyl)indazol-6-ol
PubChem CID135520431
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name1-(2-aminoethyl)indazol-6-ol
SMILESNCCn1ncc2ccc(O)cc21
InChIInChI=1S/C9H11N3O/c10-3-4-12-9-5-8(13)2-1-7(9)6-11-12/h1-2,5-6,13H,3-4,10H2
InChIKeyRVQKKYXTHSVLLB-UHFFFAOYSA-N
XLogP0.70
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)indazol-6-ol?
The IUPAC name of 1-(2-aminoethyl)indazol-6-ol (CID 135520431) is 1-(2-aminoethyl)indazol-6-ol.
What is the SMILES notation for 1-(2-aminoethyl)indazol-6-ol?
The canonical SMILES for 1-(2-aminoethyl)indazol-6-ol is NCCn1ncc2ccc(O)cc21.
What is the InChIKey of 1-(2-aminoethyl)indazol-6-ol?
The InChIKey is RVQKKYXTHSVLLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c10-3-4-12-9-5-8(13)2-1-7(9)6-11-12/h1-2,5-6,13H,3-4,10H2.
What are the key properties of 1-(2-aminoethyl)indazol-6-ol?
1-(2-aminoethyl)indazol-6-ol has a molecular weight of 177.21 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)indazol-6-ol is sourced from PubChem (CID 135520431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).