2-(2-fluoropropan-2-yl)-1H-indol-6-amine

C11H13FN2 — CID 84664033

IUPAC2-(2-fluoropropan-2-yl)-1H-indol-6-amine
SMILESCC(C)(F)c1cc2ccc(N)cc2[nH]1
InChIInChI=1S/C11H13FN2/c1-11(2,12)10-5-7-3-4-8(13)6-9(7)14-10/h3-6,14H,13H2,1-2H3
InChIKeyANWYONAOVUEIRI-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.95
Rot. Bonds1

About 2-(2-fluoropropan-2-yl)-1H-indol-6-amine

2-(2-fluoropropan-2-yl)-1H-indol-6-amine (PubChem CID 84664033) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-(2-fluoropropan-2-yl)-1H-indol-6-amine.

Molecular Properties

Compound Name2-(2-fluoropropan-2-yl)-1H-indol-6-amine
PubChem CID84664033
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name2-(2-fluoropropan-2-yl)-1H-indol-6-amine
SMILESCC(C)(F)c1cc2ccc(N)cc2[nH]1
InChIInChI=1S/C11H13FN2/c1-11(2,12)10-5-7-3-4-8(13)6-9(7)14-10/h3-6,14H,13H2,1-2H3
InChIKeyANWYONAOVUEIRI-UHFFFAOYSA-N
XLogP2.95
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoropropan-2-yl)-1H-indol-6-amine?
The IUPAC name of 2-(2-fluoropropan-2-yl)-1H-indol-6-amine (CID 84664033) is 2-(2-fluoropropan-2-yl)-1H-indol-6-amine.
What is the SMILES notation for 2-(2-fluoropropan-2-yl)-1H-indol-6-amine?
The canonical SMILES for 2-(2-fluoropropan-2-yl)-1H-indol-6-amine is CC(C)(F)c1cc2ccc(N)cc2[nH]1.
What is the InChIKey of 2-(2-fluoropropan-2-yl)-1H-indol-6-amine?
The InChIKey is ANWYONAOVUEIRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c1-11(2,12)10-5-7-3-4-8(13)6-9(7)14-10/h3-6,14H,13H2,1-2H3.
What are the key properties of 2-(2-fluoropropan-2-yl)-1H-indol-6-amine?
2-(2-fluoropropan-2-yl)-1H-indol-6-amine has a molecular weight of 192.24 g/mol, XLogP of 2.95, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoropropan-2-yl)-1H-indol-6-amine is sourced from PubChem (CID 84664033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).