2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone

C15H16FNO — CID 53417022

IUPAC2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone
SMILESO=C(CC1CCCC1)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C15H16FNO/c16-11-5-6-14-12(8-11)13(9-17-14)15(18)7-10-3-1-2-4-10/h5-6,8-10,17H,1-4,7H2
InChIKeyRYCVXSHNACNTKG-UHFFFAOYSA-N
MW245.30 g/mol
LogP4.07
Rot. Bonds3

About 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone

2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone (PubChem CID 53417022) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone
PubChem CID53417022
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone
SMILESO=C(CC1CCCC1)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C15H16FNO/c16-11-5-6-14-12(8-11)13(9-17-14)15(18)7-10-3-1-2-4-10/h5-6,8-10,17H,1-4,7H2
InChIKeyRYCVXSHNACNTKG-UHFFFAOYSA-N
XLogP4.07
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(5-bromo-1H-indol-3-yl)-2-cyclobutylethanone
CID 103162405
2-chloro-1-(5-fluoro-1H-indol-3-yl)ethanone
CID 931809
2-cyclopropyl-1-(5-methyl-1H-indol-3-yl)ethanone
CID 63553709
1-(5-fluoro-1H-indol-3-yl)-2-(4-fluorophenyl)ethanone
CID 63841273
(5-fluoro-1H-indol-3-yl)-(oxolan-2-yl)methanone
CID 63839972
N-cyclopentyl-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208021
2-cycloheptyl-1-(6-methyl-1H-indol-3-yl)ethanone
CID 114457331
2-(ethylamino)-1-(5-fluoro-1H-indol-3-yl)ethanone
CID 82493978
2-cycloheptyl-1-(2,4-difluorophenyl)ethanone
CID 114457285
1-(6-bromo-1H-indol-3-yl)-2-cyclobutylethanone
CID 103162463
1-(5-fluoro-1H-indol-3-yl)-2-(propan-2-ylamino)ethanone
CID 82496275
N-cyclopropyl-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208015

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone?
The IUPAC name of 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone (CID 53417022) is 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone.
What is the SMILES notation for 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone?
The canonical SMILES for 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone is O=C(CC1CCCC1)c1c[nH]c2ccc(F)cc12.
What is the InChIKey of 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone?
The InChIKey is RYCVXSHNACNTKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c16-11-5-6-14-12(8-11)13(9-17-14)15(18)7-10-3-1-2-4-10/h5-6,8-10,17H,1-4,7H2.
What are the key properties of 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone?
2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone has a molecular weight of 245.30 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(5-fluoro-1H-indol-3-yl)ethanone is sourced from PubChem (CID 53417022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).