5-fluoro-4-propan-2-yl-1H-indazol-3-amine

C10H12FN3 — CID 164839680

IUPAC5-fluoro-4-propan-2-yl-1H-indazol-3-amine
SMILESCC(C)c1c(F)ccc2[nH]nc(N)c12
InChIInChI=1S/C10H12FN3/c1-5(2)8-6(11)3-4-7-9(8)10(12)14-13-7/h3-5H,1-2H3,(H3,12,13,14)
InChIKeyUPKVYWYVSWMHKZ-UHFFFAOYSA-N
MW193.22 g/mol
LogP2.41
Rot. Bonds1

About 5-fluoro-4-propan-2-yl-1H-indazol-3-amine

5-fluoro-4-propan-2-yl-1H-indazol-3-amine (PubChem CID 164839680) has the molecular formula C10H12FN3 and a molecular weight of 193.22 g/mol. Its IUPAC name is 5-fluoro-4-propan-2-yl-1H-indazol-3-amine.

Molecular Properties

Compound Name5-fluoro-4-propan-2-yl-1H-indazol-3-amine
PubChem CID164839680
Molecular FormulaC10H12FN3
Molecular Weight193.22 g/mol
Exact Mass193.10
IUPAC Name5-fluoro-4-propan-2-yl-1H-indazol-3-amine
SMILESCC(C)c1c(F)ccc2[nH]nc(N)c12
InChIInChI=1S/C10H12FN3/c1-5(2)8-6(11)3-4-7-9(8)10(12)14-13-7/h3-5H,1-2H3,(H3,12,13,14)
InChIKeyUPKVYWYVSWMHKZ-UHFFFAOYSA-N
XLogP2.41
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-propan-2-yl-1H-indazol-3-amine?
The IUPAC name of 5-fluoro-4-propan-2-yl-1H-indazol-3-amine (CID 164839680) is 5-fluoro-4-propan-2-yl-1H-indazol-3-amine.
What is the SMILES notation for 5-fluoro-4-propan-2-yl-1H-indazol-3-amine?
The canonical SMILES for 5-fluoro-4-propan-2-yl-1H-indazol-3-amine is CC(C)c1c(F)ccc2[nH]nc(N)c12.
What is the InChIKey of 5-fluoro-4-propan-2-yl-1H-indazol-3-amine?
The InChIKey is UPKVYWYVSWMHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3/c1-5(2)8-6(11)3-4-7-9(8)10(12)14-13-7/h3-5H,1-2H3,(H3,12,13,14).
What are the key properties of 5-fluoro-4-propan-2-yl-1H-indazol-3-amine?
5-fluoro-4-propan-2-yl-1H-indazol-3-amine has a molecular weight of 193.22 g/mol, XLogP of 2.41, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-propan-2-yl-1H-indazol-3-amine is sourced from PubChem (CID 164839680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).