2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone

C18H14FNO — CID 82782504

IUPAC2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone
SMILESO=C(c1ccc2c(c1)CCC2)c1c[nH]c2cccc(F)c12
InChIInChI=1S/C18H14FNO/c19-15-5-2-6-16-17(15)14(10-20-16)18(21)13-8-7-11-3-1-4-12(11)9-13/h2,5-10,20H,1,3-4H2
InChIKeyPRVFNDQFSILHBZ-UHFFFAOYSA-N
MW279.31 g/mol
LogP4.03
Rot. Bonds2

About 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone

2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone (PubChem CID 82782504) has the molecular formula C18H14FNO and a molecular weight of 279.31 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone
PubChem CID82782504
Molecular FormulaC18H14FNO
Molecular Weight279.31 g/mol
Exact Mass279.11
IUPAC Name2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone
SMILESO=C(c1ccc2c(c1)CCC2)c1c[nH]c2cccc(F)c12
InChIInChI=1S/C18H14FNO/c19-15-5-2-6-16-17(15)14(10-20-16)18(21)13-8-7-11-3-1-4-12(11)9-13/h2,5-10,20H,1,3-4H2
InChIKeyPRVFNDQFSILHBZ-UHFFFAOYSA-N
XLogP4.03
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-amino-4-fluorophenyl)-(4-fluoro-1H-indol-3-yl)methanone
CID 82793459
5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(4-fluoro-1H-indol-3-yl)methanone
CID 82782505
2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone
CID 43338936
(3-chlorophenyl)-(4-fluoro-1H-indol-3-yl)methanone
CID 82792283
(2,3-difluorophenyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
CID 62649815
(3-bromo-5-fluorophenyl)-(4-fluoro-1H-indol-3-yl)methanone
CID 82793362
(4-bromo-1H-indol-3-yl)-(1,3-dihydro-2-benzofuran-5-yl)methanone
CID 115351607
(4-fluoro-1H-indol-3-yl)-(5-iodothiophen-3-yl)methanone
CID 82793082
(3-chloro-4-fluorophenyl)-(4-chloro-1H-indol-3-yl)methanone
CID 82874432
2-(4-fluoro-1H-indole-3-carbonyl)benzoic acid
CID 82782160
(2-bromo-3-fluorophenyl)-(4-fluoro-1H-indol-3-yl)methanone
CID 82791826
(2,4-dibromophenyl)-(4-fluoro-1H-indol-3-yl)methanone
CID 107950019

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone (CID 82782504) is 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone is O=C(c1ccc2c(c1)CCC2)c1c[nH]c2cccc(F)c12.
What is the InChIKey of 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone?
The InChIKey is PRVFNDQFSILHBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FNO/c19-15-5-2-6-16-17(15)14(10-20-16)18(21)13-8-7-11-3-1-4-12(11)9-13/h2,5-10,20H,1,3-4H2.
What are the key properties of 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone?
2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone has a molecular weight of 279.31 g/mol, XLogP of 4.03, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-5-yl-(4-fluoro-1H-indol-3-yl)methanone is sourced from PubChem (CID 82782504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).