(4-fluoro-2-methylindazol-3-yl)methanamine

C9H10FN3 — CID 84718090

IUPAC(4-fluoro-2-methylindazol-3-yl)methanamine
SMILESCn1nc2cccc(F)c2c1CN
InChIInChI=1S/C9H10FN3/c1-13-8(5-11)9-6(10)3-2-4-7(9)12-13/h2-4H,5,11H2,1H3
InChIKeySNBOSDPIBJEXKE-UHFFFAOYSA-N
MW179.20 g/mol
LogP1.17
Rot. Bonds1

About (4-fluoro-2-methylindazol-3-yl)methanamine

(4-fluoro-2-methylindazol-3-yl)methanamine (PubChem CID 84718090) has the molecular formula C9H10FN3 and a molecular weight of 179.20 g/mol. Its IUPAC name is (4-fluoro-2-methylindazol-3-yl)methanamine.

Molecular Properties

Compound Name(4-fluoro-2-methylindazol-3-yl)methanamine
PubChem CID84718090
Molecular FormulaC9H10FN3
Molecular Weight179.20 g/mol
Exact Mass179.09
IUPAC Name(4-fluoro-2-methylindazol-3-yl)methanamine
SMILESCn1nc2cccc(F)c2c1CN
InChIInChI=1S/C9H10FN3/c1-13-8(5-11)9-6(10)3-2-4-7(9)12-13/h2-4H,5,11H2,1H3
InChIKeySNBOSDPIBJEXKE-UHFFFAOYSA-N
XLogP1.17
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.20
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-methylindazol-3-yl)methanamine?
The IUPAC name of (4-fluoro-2-methylindazol-3-yl)methanamine (CID 84718090) is (4-fluoro-2-methylindazol-3-yl)methanamine.
What is the SMILES notation for (4-fluoro-2-methylindazol-3-yl)methanamine?
The canonical SMILES for (4-fluoro-2-methylindazol-3-yl)methanamine is Cn1nc2cccc(F)c2c1CN.
What is the InChIKey of (4-fluoro-2-methylindazol-3-yl)methanamine?
The InChIKey is SNBOSDPIBJEXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN3/c1-13-8(5-11)9-6(10)3-2-4-7(9)12-13/h2-4H,5,11H2,1H3.
What are the key properties of (4-fluoro-2-methylindazol-3-yl)methanamine?
(4-fluoro-2-methylindazol-3-yl)methanamine has a molecular weight of 179.20 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-methylindazol-3-yl)methanamine is sourced from PubChem (CID 84718090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).