1-hydroxy-N-propan-2-ylindazol-3-amine

C10H13N3O — CID 166796836

IUPAC1-hydroxy-N-propan-2-ylindazol-3-amine
SMILESCC(C)Nc1nn(O)c2ccccc12
InChIInChI=1S/C10H13N3O/c1-7(2)11-10-8-5-3-4-6-9(8)13(14)12-10/h3-7,14H,1-2H3,(H,11,12)
InChIKeyKQUINSUTECXIMC-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.09
Rot. Bonds2

About 1-hydroxy-N-propan-2-ylindazol-3-amine

1-hydroxy-N-propan-2-ylindazol-3-amine (PubChem CID 166796836) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 1-hydroxy-N-propan-2-ylindazol-3-amine.

Molecular Properties

Compound Name1-hydroxy-N-propan-2-ylindazol-3-amine
PubChem CID166796836
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name1-hydroxy-N-propan-2-ylindazol-3-amine
SMILESCC(C)Nc1nn(O)c2ccccc12
InChIInChI=1S/C10H13N3O/c1-7(2)11-10-8-5-3-4-6-9(8)13(14)12-10/h3-7,14H,1-2H3,(H,11,12)
InChIKeyKQUINSUTECXIMC-UHFFFAOYSA-N
XLogP2.09
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-propan-2-ylindazol-3-amine?
The IUPAC name of 1-hydroxy-N-propan-2-ylindazol-3-amine (CID 166796836) is 1-hydroxy-N-propan-2-ylindazol-3-amine.
What is the SMILES notation for 1-hydroxy-N-propan-2-ylindazol-3-amine?
The canonical SMILES for 1-hydroxy-N-propan-2-ylindazol-3-amine is CC(C)Nc1nn(O)c2ccccc12.
What is the InChIKey of 1-hydroxy-N-propan-2-ylindazol-3-amine?
The InChIKey is KQUINSUTECXIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-7(2)11-10-8-5-3-4-6-9(8)13(14)12-10/h3-7,14H,1-2H3,(H,11,12).
What are the key properties of 1-hydroxy-N-propan-2-ylindazol-3-amine?
1-hydroxy-N-propan-2-ylindazol-3-amine has a molecular weight of 191.23 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-propan-2-ylindazol-3-amine is sourced from PubChem (CID 166796836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).