4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one

C123H143F5N14O6 — CID 159100618

IUPAC4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one
SMILESCOc1ccccc1N1CCN(C2CC=C(c3c[nH]c4ccc(F)cc34)CC2)CC1.COc1ccccc1N1CCN(C2CCC(=O)CC2)CC1.COc1ccccc1N1CCN(C2CCC(c3c[nH]c4ccc(F)cc34)CC2)CC1.Cn1cc(C2CCC(=O)CC2)c2cc(F)ccc21.Cn1cc(C2CCC(N3CCN(c4cccc5[nH]ccc45)CC3)CC2)c2cc(F)ccc21.O=C1CCC(c2c[nH]c3ccc(F)cc23)CC1
InChIInChI=1S/C27H31FN4.C25H30FN3O.C25H28FN3O.C17H24N2O2.C15H16FNO.C14H14FNO/c1-30-18-24(23-17-20(28)7-10-26(23)30)19-5-8-21(9-6-19)31-13-15-32(16-14-31)27-4-2-3-25-22(27)11-12-29-25;2*1-30-25-5-3-2-4-24(25)29-14-12-28(13-15-29)20-9-6-18(7-10-20)22-17-27-23-11-8-19(26)16-21(22)23;1-21-17-5-3-2-4-16(17)19-12-10-18(11-13-19)14-6-8-15(20)9-7-14;1-17-9-14(10-2-5-12(18)6-3-10)13-8-11(16)4-7-15(13)17;15-10-3-6-14-12(7-10)13(8-16-14)9-1-4-11(17)5-2-9/h2-4,7,10-12,17-19,21,29H,5-6,8-9,13-16H2,1H3;2-5,8,11,16-18,20,27H,6-7,9-10,12-15H2,1H3;2-6,8,11,16-17,20,27H,7,9-10,12-15H2,1H3;2-5,14H,6-13H2,1H3;4,7-10H,2-3,5-6H2,1H3;3,6-9,16H,1-2,4-5H2
InChIKeyKDFOTNQRSWTGSD-UHFFFAOYSA-N
MW2008.58 g/mol
LogP25.29
Rot. Bonds16

About 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one

4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one (PubChem CID 159100618) has the molecular formula C123H143F5N14O6 and a molecular weight of 2008.58 g/mol. Its IUPAC name is 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one.

Molecular Properties

Compound Name4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one
PubChem CID159100618
Molecular FormulaC123H143F5N14O6
Molecular Weight2008.58 g/mol
Exact Mass2007.12
IUPAC Name4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one
SMILESCOc1ccccc1N1CCN(C2CC=C(c3c[nH]c4ccc(F)cc34)CC2)CC1.COc1ccccc1N1CCN(C2CCC(=O)CC2)CC1.COc1ccccc1N1CCN(C2CCC(c3c[nH]c4ccc(F)cc34)CC2)CC1.Cn1cc(C2CCC(=O)CC2)c2cc(F)ccc21.Cn1cc(C2CCC(N3CCN(c4cccc5[nH]ccc45)CC3)CC2)c2cc(F)ccc21.O=C1CCC(c2c[nH]c3ccc(F)cc23)CC1
InChIInChI=1S/C27H31FN4.C25H30FN3O.C25H28FN3O.C17H24N2O2.C15H16FNO.C14H14FNO/c1-30-18-24(23-17-20(28)7-10-26(23)30)19-5-8-21(9-6-19)31-13-15-32(16-14-31)27-4-2-3-25-22(27)11-12-29-25;2*1-30-25-5-3-2-4-24(25)29-14-12-28(13-15-29)20-9-6-18(7-10-20)22-17-27-23-11-8-19(26)16-21(22)23;1-21-17-5-3-2-4-16(17)19-12-10-18(11-13-19)14-6-8-15(20)9-7-14;1-17-9-14(10-2-5-12(18)6-3-10)13-8-11(16)4-7-15(13)17;15-10-3-6-14-12(7-10)13(8-16-14)9-1-4-11(17)5-2-9/h2-4,7,10-12,17-19,21,29H,5-6,8-9,13-16H2,1H3;2-5,8,11,16-18,20,27H,6-7,9-10,12-15H2,1H3;2-6,8,11,16-17,20,27H,7,9-10,12-15H2,1H3;2-5,14H,6-13H2,1H3;4,7-10H,2-3,5-6H2,1H3;3,6-9,16H,1-2,4-5H2
InChIKeyKDFOTNQRSWTGSD-UHFFFAOYSA-N
XLogP25.29
TPSA177.84 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds16
Heavy Atoms148
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002008.58
LogP ≤ 525.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1016

Analyze 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one with MolForge

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Related Compounds

1-(2,9-dimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,9-dimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)-4-(5-fluoro-2-pyridinyl)pyridin-2-one;4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-[6-(trifluoromethyl)-3-pyridinyl]pyridin-2-one;1-(6,7,8,9-tetrahydro-5H-carbazol-2-yl)-4-[5-(trifluoromethyl)-2-pyridinyl]pyridin-2-one
CID 157597994
1-(1-Aminocyclohexyl)-5-[5-[[5-[(2,6-dimethylphenyl)methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[5-[[5-[(2-methylphenyl)methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[5-[[5-[[2-methyl-6-(trifluoromethyl)phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[3-[4-(trifluoromethoxy)phenyl]-5-[[5-[[2-(trifluoromethyl)phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]indol-1-yl]pentan-1-one
CID 158639602
1-(1-Aminocyclohexyl)-5-[5-[(4-ethylpiperazin-1-yl)methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[5-[(4-methylpiperazin-1-yl)methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[5-[(4-phenylpiperazin-1-yl)methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[5-(piperazin-1-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[5-[(4-propan-2-ylpiperazin-1-yl)methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one
CID 159989841
1-(1-Aminocyclohexyl)-5-[5-[[5-[(2-methoxy-6-methylphenyl)methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[5-[[5-[[2-methyl-6-(trifluoromethoxy)phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]pentan-1-one;1-(1-aminocyclohexyl)-5-[3-[4-(trifluoromethoxy)phenyl]-5-[[5-[[2-(trifluoromethoxy)phenyl]methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]indol-1-yl]pentan-1-one;5-[5-[(5-benzyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]-1-piperidin-2-ylpentan-1-one;5-[5-[[5-[(2-methylphenyl)methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]-1-piperidin-2-ylpentan-1-one
CID 160636492
2,4-bis(1H-indol-3-yl)-1,5-bis(2-methoxyanilino)-1,5-bis[6-(trifluoromethyl)-3-pyridinyl]pentan-3-one
CID 174735227
1,5-bis(2-fluorophenyl)-2,4-bis(1H-indol-3-yl)-1,5-bis(2-methoxyanilino)pentan-3-one
CID 174735344
2,4-bis(5-fluoro-1H-indol-3-yl)-1,5-bis(6-methoxy-3-pyridinyl)-1,5-bis[(5-methoxy-3-pyridinyl)amino]pentan-3-one
CID 174735539
1,5-bis(4-fluorophenyl)-2,4-bis(1H-indol-3-yl)-1,5-bis(2-methoxyanilino)pentan-3-one
CID 174735548
1,5-bis(4,8-dimethoxy-9H-pyrido[3,4-b]indol-1-yl)-1,5-bis(9H-pyrido[3,4-b]indol-1-yl)pentan-3-one
CID 150246540
1-Isocyanato-2-methoxybenzene;1-(2-methoxyphenyl)-3-[4-(1-methylpyrrolo[2,3-c]pyridin-3-yl)phenyl]propan-2-one;1-methyl-3-(4-methylphenyl)pyrrolo[2,3-c]pyridine;4-(1-methylpyrrolo[2,3-c]pyridin-6-ium-3-yl)aniline
CID 158026762
1-[4-(6-fluoro-3H-inden-1-yl)cyclohexyl]-4-(2-methoxyphenyl)piperazine;4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one
CID 159134308
1-ethyl-5-(5-fluoro-3-pyridinyl)-3H-indol-2-one;1-ethyl-5-pyridin-3-yl-3H-indol-2-one;5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one;5-(5-fluoro-3-pyridinyl)-1-methyl-3H-indol-2-one;5-(5-methoxy-3-pyridinyl)-1,3-dihydroindol-2-one;1-methyl-5-pyridin-3-yl-3H-indol-2-one
CID 159570838

Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one?
The IUPAC name of 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one (CID 159100618) is 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one.
What is the SMILES notation for 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one?
The canonical SMILES for 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one is COc1ccccc1N1CCN(C2CC=C(c3c[nH]c4ccc(F)cc34)CC2)CC1.COc1ccccc1N1CCN(C2CCC(=O)CC2)CC1.COc1ccccc1N1CCN(C2CCC(c3c[nH]c4ccc(F)cc34)CC2)CC1.Cn1cc(C2CCC(=O)CC2)c2cc(F)ccc21.Cn1cc(C2CCC(N3CCN(c4cccc5[nH]ccc45)CC3)CC2)c2cc(F)ccc21.O=C1CCC(c2c[nH]c3ccc(F)cc23)CC1.
What is the InChIKey of 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one?
The InChIKey is KDFOTNQRSWTGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H31FN4.C25H30FN3O.C25H28FN3O.C17H24N2O2.C15H16FNO.C14H14FNO/c1-30-18-24(23-17-20(28)7-10-26(23)30)19-5-8-21(9-6-19)31-13-15-32(16-14-31)27-4-2-3-25-22(27)11-12-29-25;2*1-30-25-5-3-2-4-24(25)29-14-12-28(13-15-29)20-9-6-18(7-10-20)22-17-27-23-11-8-19(26)16-21(22)23;1-21-17-5-3-2-4-16(17)19-12-10-18(11-13-19)14-6-8-15(20)9-7-14;1-17-9-14(10-2-5-12(18)6-3-10)13-8-11(16)4-7-15(13)17;15-10-3-6-14-12(7-10)13(8-16-14)9-1-4-11(17)5-2-9/h2-4,7,10-12,17-19,21,29H,5-6,8-9,13-16H2,1H3;2-5,8,11,16-18,20,27H,6-7,9-10,12-15H2,1H3;2-6,8,11,16-17,20,27H,7,9-10,12-15H2,1H3;2-5,14H,6-13H2,1H3;4,7-10H,2-3,5-6H2,1H3;3,6-9,16H,1-2,4-5H2.
What are the key properties of 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one?
4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one has a molecular weight of 2008.58 g/mol, XLogP of 25.29, 16 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-1H-indol-3-yl)cyclohexan-1-one;5-fluoro-3-[4-[4-(1H-indol-4-yl)piperazin-1-yl]cyclohexyl]-1-methylindole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexen-1-yl]-1H-indole;5-fluoro-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl]-1H-indole;4-(5-fluoro-1-methylindol-3-yl)cyclohexan-1-one;4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one is sourced from PubChem (CID 159100618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).