[1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone

C25H24FNO — CID 91707981

IUPAC[1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone
SMILESCCCC(F)Cn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21
InChIInChI=1S/C25H24FNO/c1-3-8-18(26)15-27-16-23(21-11-6-7-12-24(21)27)25(28)22-14-13-17(2)19-9-4-5-10-20(19)22/h4-7,9-14,16,18H,3,8,15H2,1-2H3
InChIKeyGKGOOBXNSBWSAR-UHFFFAOYSA-N
MW373.47 g/mol
LogP6.47
Rot. Bonds6

About [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone

[1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone (PubChem CID 91707981) has the molecular formula C25H24FNO and a molecular weight of 373.47 g/mol. Its IUPAC name is [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone.

Molecular Properties

Compound Name[1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone
PubChem CID91707981
Molecular FormulaC25H24FNO
Molecular Weight373.47 g/mol
Exact Mass373.18
IUPAC Name[1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone
SMILESCCCC(F)Cn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21
InChIInChI=1S/C25H24FNO/c1-3-8-18(26)15-27-16-23(21-11-6-7-12-24(21)27)25(28)22-14-13-17(2)19-9-4-5-10-20(19)22/h4-7,9-14,16,18H,3,8,15H2,1-2H3
InChIKeyGKGOOBXNSBWSAR-UHFFFAOYSA-N
XLogP6.47
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.47
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(2-hydroxypentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone
CID 165361507
[1-(2-fluoropentyl)indol-3-yl]-naphthalen-1-ylmethanone
CID 132989243
[1-[(4S)-4-hydroxypentyl]indol-3-yl]-(4-methylnaphthalen-1-yl)methanone
CID 97301455
1-(2-fluoropentyl)-N-naphthalen-1-ylindole-3-carboxamide
CID 132989244
5-[3-(4-methylnaphthalene-1-carbonyl)indol-1-yl]pentanoic acid
CID 91864527
(4-chloronaphthalen-1-yl)-(1-propylindol-3-yl)methanone
CID 71461422
[1-(2-hydroxypentyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 132989410
(4-ethoxynaphthalen-1-yl)-(1-pentylindol-3-yl)methanone
CID 45267043
(4-methylnaphthalen-1-yl)-(2-methyl-1-propylindol-3-yl)methanone
CID 45267819
(4-methylphenyl)-[1-(2-methylpropyl)indol-3-yl]methanone
CID 102235826
(1-butylindazol-3-yl)-(4-methylnaphthalen-1-yl)methanone
CID 170857562
(4-methylphenyl)-(1-propylindol-3-yl)methanone
CID 170857121

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone?
The IUPAC name of [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone (CID 91707981) is [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone.
What is the SMILES notation for [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone?
The canonical SMILES for [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone is CCCC(F)Cn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21.
What is the InChIKey of [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone?
The InChIKey is GKGOOBXNSBWSAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24FNO/c1-3-8-18(26)15-27-16-23(21-11-6-7-12-24(21)27)25(28)22-14-13-17(2)19-9-4-5-10-20(19)22/h4-7,9-14,16,18H,3,8,15H2,1-2H3.
What are the key properties of [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone?
[1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone has a molecular weight of 373.47 g/mol, XLogP of 6.47, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoropentyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone is sourced from PubChem (CID 91707981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).