ethane;7-fluoro-2,3-dihydro-1H-indole

C10H14FN — CID 171527172

IUPACethane;7-fluoro-2,3-dihydro-1H-indole
SMILESCC.Fc1cccc2c1NCC2
InChIInChI=1S/C8H8FN.C2H6/c9-7-3-1-2-6-4-5-10-8(6)7;1-2/h1-3,10H,4-5H2;1-2H3
InChIKeyDVKRLJRGFROLFH-UHFFFAOYSA-N
MW167.23 g/mol
LogP2.82
Rot. Bonds

About ethane;7-fluoro-2,3-dihydro-1H-indole

ethane;7-fluoro-2,3-dihydro-1H-indole (PubChem CID 171527172) has the molecular formula C10H14FN and a molecular weight of 167.23 g/mol. Its IUPAC name is ethane;7-fluoro-2,3-dihydro-1H-indole.

Molecular Properties

Compound Nameethane;7-fluoro-2,3-dihydro-1H-indole
PubChem CID171527172
Molecular FormulaC10H14FN
Molecular Weight167.23 g/mol
Exact Mass167.11
IUPAC Nameethane;7-fluoro-2,3-dihydro-1H-indole
SMILESCC.Fc1cccc2c1NCC2
InChIInChI=1S/C8H8FN.C2H6/c9-7-3-1-2-6-4-5-10-8(6)7;1-2/h1-3,10H,4-5H2;1-2H3
InChIKeyDVKRLJRGFROLFH-UHFFFAOYSA-N
XLogP2.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.23
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;7-fluoro-2,3-dihydro-1H-indole?
The IUPAC name of ethane;7-fluoro-2,3-dihydro-1H-indole (CID 171527172) is ethane;7-fluoro-2,3-dihydro-1H-indole.
What is the SMILES notation for ethane;7-fluoro-2,3-dihydro-1H-indole?
The canonical SMILES for ethane;7-fluoro-2,3-dihydro-1H-indole is CC.Fc1cccc2c1NCC2.
What is the InChIKey of ethane;7-fluoro-2,3-dihydro-1H-indole?
The InChIKey is DVKRLJRGFROLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN.C2H6/c9-7-3-1-2-6-4-5-10-8(6)7;1-2/h1-3,10H,4-5H2;1-2H3.
What are the key properties of ethane;7-fluoro-2,3-dihydro-1H-indole?
ethane;7-fluoro-2,3-dihydro-1H-indole has a molecular weight of 167.23 g/mol, XLogP of 2.82, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-fluoro-2,3-dihydro-1H-indole is sourced from PubChem (CID 171527172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).