5-fluoro-3-propyl-2,3-dihydro-1H-indole

C11H14FN — CID 70323615

IUPAC5-fluoro-3-propyl-2,3-dihydro-1H-indole
SMILESCCCC1CNc2ccc(F)cc21
InChIInChI=1S/C11H14FN/c1-2-3-8-7-13-11-5-4-9(12)6-10(8)11/h4-6,8,13H,2-3,7H2,1H3
InChIKeyAMPOIKZSFRGANF-UHFFFAOYSA-N
MW179.24 g/mol
LogP3.13
Rot. Bonds2

About 5-fluoro-3-propyl-2,3-dihydro-1H-indole

5-fluoro-3-propyl-2,3-dihydro-1H-indole (PubChem CID 70323615) has the molecular formula C11H14FN and a molecular weight of 179.24 g/mol. Its IUPAC name is 5-fluoro-3-propyl-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name5-fluoro-3-propyl-2,3-dihydro-1H-indole
PubChem CID70323615
Molecular FormulaC11H14FN
Molecular Weight179.24 g/mol
Exact Mass179.11
IUPAC Name5-fluoro-3-propyl-2,3-dihydro-1H-indole
SMILESCCCC1CNc2ccc(F)cc21
InChIInChI=1S/C11H14FN/c1-2-3-8-7-13-11-5-4-9(12)6-10(8)11/h4-6,8,13H,2-3,7H2,1H3
InChIKeyAMPOIKZSFRGANF-UHFFFAOYSA-N
XLogP3.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-fluoro-3-[(5-fluoro-2,3-dihydro-1H-indol-3-yl)methyl]-2,3-dihydro-1H-indole
CID 50902602
2-(5-fluoro-2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine;molecular hydrogen
CID 166138415
(3R)-5-methoxy-3-propyl-2,3-dihydro-1H-indole
CID 124549466
5-fluoro-2,3-dihydro-1H-indol-3-amine
CID 84739506
O-[(5-fluoro-2,3-dihydro-1H-indol-3-yl)methyl]hydroxylamine
CID 117202128
N-methyl-1-(3-propyl-2,3-dihydro-1H-indol-5-yl)methanamine
CID 83960289
(5-fluoro-2,3-dihydro-1H-indol-3-yl)methyl acetate
CID 172766683
3-butyl-5-methyl-2,3-dihydro-1H-indole
CID 106820126
6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline
CID 84618460
(3S)-5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-2,3-dihydro-1H-indole
CID 169244473
3-(1,1-difluoroethyl)-5-fluoro-2,3-dihydro-1H-indole
CID 84669875
6-fluoro-4-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline
CID 105460978

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-propyl-2,3-dihydro-1H-indole?
The IUPAC name of 5-fluoro-3-propyl-2,3-dihydro-1H-indole (CID 70323615) is 5-fluoro-3-propyl-2,3-dihydro-1H-indole.
What is the SMILES notation for 5-fluoro-3-propyl-2,3-dihydro-1H-indole?
The canonical SMILES for 5-fluoro-3-propyl-2,3-dihydro-1H-indole is CCCC1CNc2ccc(F)cc21.
What is the InChIKey of 5-fluoro-3-propyl-2,3-dihydro-1H-indole?
The InChIKey is AMPOIKZSFRGANF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN/c1-2-3-8-7-13-11-5-4-9(12)6-10(8)11/h4-6,8,13H,2-3,7H2,1H3.
What are the key properties of 5-fluoro-3-propyl-2,3-dihydro-1H-indole?
5-fluoro-3-propyl-2,3-dihydro-1H-indole has a molecular weight of 179.24 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-propyl-2,3-dihydro-1H-indole is sourced from PubChem (CID 70323615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).