4-fluoro-N-methyl-1H-indol-2-amine

C9H9FN2 — CID 143863709

IUPAC4-fluoro-N-methyl-1H-indol-2-amine
SMILESCNc1cc2c(F)cccc2[nH]1
InChIInChI=1S/C9H9FN2/c1-11-9-5-6-7(10)3-2-4-8(6)12-9/h2-5,11-12H,1H3
InChIKeyRVXNWQDYXYHDHN-UHFFFAOYSA-N
MW164.18 g/mol
LogP2.35
Rot. Bonds1

About 4-fluoro-N-methyl-1H-indol-2-amine

4-fluoro-N-methyl-1H-indol-2-amine (PubChem CID 143863709) has the molecular formula C9H9FN2 and a molecular weight of 164.18 g/mol. Its IUPAC name is 4-fluoro-N-methyl-1H-indol-2-amine.

Molecular Properties

Compound Name4-fluoro-N-methyl-1H-indol-2-amine
PubChem CID143863709
Molecular FormulaC9H9FN2
Molecular Weight164.18 g/mol
Exact Mass164.07
IUPAC Name4-fluoro-N-methyl-1H-indol-2-amine
SMILESCNc1cc2c(F)cccc2[nH]1
InChIInChI=1S/C9H9FN2/c1-11-9-5-6-7(10)3-2-4-8(6)12-9/h2-5,11-12H,1H3
InChIKeyRVXNWQDYXYHDHN-UHFFFAOYSA-N
XLogP2.35
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.18
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-methyl-1H-indol-2-amine?
The IUPAC name of 4-fluoro-N-methyl-1H-indol-2-amine (CID 143863709) is 4-fluoro-N-methyl-1H-indol-2-amine.
What is the SMILES notation for 4-fluoro-N-methyl-1H-indol-2-amine?
The canonical SMILES for 4-fluoro-N-methyl-1H-indol-2-amine is CNc1cc2c(F)cccc2[nH]1.
What is the InChIKey of 4-fluoro-N-methyl-1H-indol-2-amine?
The InChIKey is RVXNWQDYXYHDHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN2/c1-11-9-5-6-7(10)3-2-4-8(6)12-9/h2-5,11-12H,1H3.
What are the key properties of 4-fluoro-N-methyl-1H-indol-2-amine?
4-fluoro-N-methyl-1H-indol-2-amine has a molecular weight of 164.18 g/mol, XLogP of 2.35, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-methyl-1H-indol-2-amine is sourced from PubChem (CID 143863709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).