6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one

C94H120N12O8 — CID 158101988

IUPAC6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one
SMILESCCOc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)N(C)C(=O)CC2.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)C(C)(C)C(=O)N2C.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)CCC(=O)N2C.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)N(C)C(=O)CC2
InChIInChI=1S/2C24H31N3O2.2C23H29N3O2/c1-24(2)18-13-17(21(29-4)14-20(18)27(3)23(24)28)15-26-19-11-8-12-25-22(19)16-9-6-5-7-10-16;1-3-29-22-15-18-11-12-23(28)27(2)21(18)14-19(22)16-26-20-10-7-13-25-24(20)17-8-5-4-6-9-17;1-26-20-13-18(21(28-2)14-17(20)10-11-22(26)27)15-25-19-9-6-12-24-23(19)16-7-4-3-5-8-16;1-26-20-14-21(28-2)18(13-17(20)10-11-22(26)27)15-25-19-9-6-12-24-23(19)16-7-4-3-5-8-16/h5-7,9-10,13-14,19,22,25-26H,8,11-12,15H2,1-4H3;4-6,8-9,14-15,20,24-26H,3,7,10-13,16H2,1-2H3;2*3-5,7-8,13-14,19,23-25H,6,9-12,15H2,1-2H3/t19?,22-;20?,24-;2*19?,23-/m0000/s1
InChIKeyFPJKCGMWINWCQN-VAXXXORJSA-N
MW1546.07 g/mol
LogP13.48
Rot. Bonds21

About 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one

6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one (PubChem CID 158101988) has the molecular formula C94H120N12O8 and a molecular weight of 1546.07 g/mol. Its IUPAC name is 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one.

Molecular Properties

Compound Name6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one
PubChem CID158101988
Molecular FormulaC94H120N12O8
Molecular Weight1546.07 g/mol
Exact Mass1544.94
IUPAC Name6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one
SMILESCCOc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)N(C)C(=O)CC2.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)C(C)(C)C(=O)N2C.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)CCC(=O)N2C.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)N(C)C(=O)CC2
InChIInChI=1S/2C24H31N3O2.2C23H29N3O2/c1-24(2)18-13-17(21(29-4)14-20(18)27(3)23(24)28)15-26-19-11-8-12-25-22(19)16-9-6-5-7-10-16;1-3-29-22-15-18-11-12-23(28)27(2)21(18)14-19(22)16-26-20-10-7-13-25-24(20)17-8-5-4-6-9-17;1-26-20-13-18(21(28-2)14-17(20)10-11-22(26)27)15-25-19-9-6-12-24-23(19)16-7-4-3-5-8-16;1-26-20-14-21(28-2)18(13-17(20)10-11-22(26)27)15-25-19-9-6-12-24-23(19)16-7-4-3-5-8-16/h5-7,9-10,13-14,19,22,25-26H,8,11-12,15H2,1-4H3;4-6,8-9,14-15,20,24-26H,3,7,10-13,16H2,1-2H3;2*3-5,7-8,13-14,19,23-25H,6,9-12,15H2,1-2H3/t19?,22-;20?,24-;2*19?,23-/m0000/s1
InChIKeyFPJKCGMWINWCQN-VAXXXORJSA-N
XLogP13.48
TPSA214.40 Ų
H-Bond Donors8
H-Bond Acceptors16
Rotatable Bonds21
Heavy Atoms114
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001546.07
LogP ≤ 513.48
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1016

Analyze 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(5-Tert-butyl-2-methoxyanilino)-6-methylidenepiperidin-2-one;5-[3-methoxy-5-(trifluoromethyl)anilino]-6-methylidenepiperidin-2-one;5-(4-methylanilino)-6-methylidenepiperidin-2-one;6-methylidene-5-[4-(morpholin-4-ylmethyl)anilino]piperidin-2-one;6-methylidene-5-(3-phenoxyanilino)piperidin-2-one;6-methylidene-5-(4-phenoxyanilino)piperidin-2-one;6-methylidene-5-(3-propoxyanilino)piperidin-2-one
CID 158508455
5-[[(2-Benzhydryl-1-azabicyclo[2.2.2]octan-3-yl)amino]methyl]-6-methoxy-1,3,3-trimethylindol-2-one
CID 21705408
5-[[[(2S,3S)-2-benzhydryl-1-azabicyclo[2.2.2]octan-3-yl]amino]methyl]-6-methoxy-1,3,3-trimethylindol-2-one
CID 20685147
6-Methoxy-1-methyl-7-[[[1-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[(2-phenyl-1-propan-2-ylpiperidin-3-yl)amino]methyl]indol-2-one
CID 136439164
N-(cyclohexylmethyl)-2-[4-[(3R,4R)-3-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidin-4-yl]phenoxy]ethanamine;7-[[(3R,4R)-4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]piperidin-3-yl]oxymethyl]-3,3-dimethyl-1H-indol-2-one;2-(2-methoxyphenyl)-N-[2-[4-[(3R,4R)-3-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidin-4-yl]phenoxy]ethyl]ethanamine;N-[3-[4-[(3R,4R)-3-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidin-4-yl]phenoxy]propyl]cyclohexanamine
CID 157287903
6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S,3S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]quinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one
CID 159069508
1-(4-amino-1-bicyclo[2.2.2]octanyl)-2-(4-tert-butylphenyl)ethanone;4-amino-N-(3-tert-butylphenyl)bicyclo[2.2.2]octane-1-carboxamide;4-[2-(3-tert-butylphenoxy)ethyl]morpholine;1-[2-(3-tert-butylphenoxy)ethyl]pyrrolidin-2-one;4-[(3-tert-butylphenoxy)methyl]bicyclo[2.2.2]octan-1-amine;4-[(4-tert-butylphenoxy)methyl]bicyclo[2.2.2]octan-1-amine;1-[(4-tert-butylphenyl)methyl]-4-methylpiperazine;4-[(4-tert-butylphenyl)methyl]-1-methylpiperidine;4-[(4-tert-butylphenyl)methyl]morpholine
CID 159741582
6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;molecular hydrogen;1,3,3,6-tetramethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one
CID 160288000
1-(6-tert-butyl-5-methoxy-2,3-dihydroindol-1-yl)-2-(dimethylamino)ethanone;1-(4-tert-butyl-3-methoxyphenyl)-N,N-dimethylpiperidin-4-amine;1-(4-tert-butyl-3-methoxyphenyl)-4-methylpiperazine;1-[1-(4-tert-butyl-3-methoxyphenyl)piperidin-4-yl]-4-methylpiperazine;1-(4-tert-butyl-3-methoxyphenyl)-4-pyrrolidin-1-ylpiperidine;1-(4-tert-butylphenyl)-4-methylpiperazine
CID 161135509
5-(benzylamino)-1-propan-2-ylspiro[indole-3,4'-piperidine]-2-one;6-methoxy-5-methyl-1-propan-2-ylspiro[indole-3,4'-piperidine]-2-one;1-methylsulfonylspiro[2H-indole-3,4'-piperidine];spiro[2H-1-benzofuran-3,4'-piperidine]
CID 161250679
6-tert-butyl-3,4-dihydro-1H-naphthalen-2-one;1-(6-tert-butyl-5-methoxy-2,3-dihydroindol-1-yl)-2-(dimethylamino)ethanone;4-(4-tert-butyl-5-methoxy-2-methylphenyl)-1-methylpiperidine;1-(4-tert-butyl-3-methoxyphenyl)-4-methylpiperazine;1-[1-(4-tert-butyl-3-methoxyphenyl)piperidin-4-yl]-4-methylpiperazine;1-(4-tert-butyl-3-methoxyphenyl)-4-pyrrolidin-1-ylpiperidine
CID 161307678
1-(6-tert-butyl-5-methoxy-2,3-dihydroindol-1-yl)-2-(dimethylamino)ethanone;1-(4-tert-butyl-3-methoxyphenyl)-N,N-dimethylpiperidin-4-amine;1-(4-tert-butyl-3-methoxyphenyl)-4-methylpiperazine;1-[1-(4-tert-butyl-3-methoxyphenyl)piperidin-4-yl]-4-methylpiperazine
CID 161696270

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one?
The IUPAC name of 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one (CID 158101988) is 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one.
What is the SMILES notation for 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one?
The canonical SMILES for 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one is CCOc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)N(C)C(=O)CC2.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)C(C)(C)C(=O)N2C.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)CCC(=O)N2C.COc1cc2c(cc1CNC1CCCN[C@H]1c1ccccc1)N(C)C(=O)CC2.
What is the InChIKey of 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one?
The InChIKey is FPJKCGMWINWCQN-VAXXXORJSA-N. The full InChI is InChI=1S/2C24H31N3O2.2C23H29N3O2/c1-24(2)18-13-17(21(29-4)14-20(18)27(3)23(24)28)15-26-19-11-8-12-25-22(19)16-9-6-5-7-10-16;1-3-29-22-15-18-11-12-23(28)27(2)21(18)14-19(22)16-26-20-10-7-13-25-24(20)17-8-5-4-6-9-17;1-26-20-13-18(21(28-2)14-17(20)10-11-22(26)27)15-25-19-9-6-12-24-23(19)16-7-4-3-5-8-16;1-26-20-14-21(28-2)18(13-17(20)10-11-22(26)27)15-25-19-9-6-12-24-23(19)16-7-4-3-5-8-16/h5-7,9-10,13-14,19,22,25-26H,8,11-12,15H2,1-4H3;4-6,8-9,14-15,20,24-26H,3,7,10-13,16H2,1-2H3;2*3-5,7-8,13-14,19,23-25H,6,9-12,15H2,1-2H3/t19?,22-;20?,24-;2*19?,23-/m0000/s1.
What are the key properties of 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one?
6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one has a molecular weight of 1546.07 g/mol, XLogP of 13.48, 21 rotatable bonds, 8 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1-methyl-7-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;7-methoxy-1-methyl-6-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]-3,4-dihydroquinolin-2-one;6-methoxy-1,3,3-trimethyl-5-[[[(2S)-2-phenylpiperidin-3-yl]amino]methyl]indol-2-one is sourced from PubChem (CID 158101988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).