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

C107H173N13O6 — CID 161135509

IUPAC1-(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
SMILESCN1CCN(c2ccc(C(C)(C)C)cc2)CC1.COc1cc(N2CCC(N(C)C)CC2)ccc1C(C)(C)C.COc1cc(N2CCC(N3CCCC3)CC2)ccc1C(C)(C)C.COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1C(C)(C)C.COc1cc(N2CCN(C)CC2)ccc1C(C)(C)C.COc1cc2c(cc1C(C)(C)C)N(C(=O)CN(C)C)CC2
InChIInChI=1S/C21H35N3O.C20H32N2O.C18H30N2O.C17H26N2O2.C16H26N2O.C15H24N2/c1-21(2,3)19-7-6-18(16-20(19)25-5)23-10-8-17(9-11-23)24-14-12-22(4)13-15-24;1-20(2,3)18-8-7-17(15-19(18)23-4)22-13-9-16(10-14-22)21-11-5-6-12-21;1-18(2,3)16-8-7-15(13-17(16)21-6)20-11-9-14(10-12-20)19(4)5;1-17(2,3)13-10-14-12(9-15(13)21-6)7-8-19(14)16(20)11-18(4)5;1-16(2,3)14-7-6-13(12-15(14)19-5)18-10-8-17(4)9-11-18;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17/h6-7,16-17H,8-15H2,1-5H3;7-8,15-16H,5-6,9-14H2,1-4H3;7-8,13-14H,9-12H2,1-6H3;9-10H,7-8,11H2,1-6H3;6-7,12H,8-11H2,1-5H3;5-8H,9-12H2,1-4H3
InChIKeyUMSWYYXYGMSIOI-UHFFFAOYSA-N
MW1737.65 g/mol
LogP18.71
Rot. Bonds15

About 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

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 (PubChem CID 161135509) has the molecular formula C107H173N13O6 and a molecular weight of 1737.65 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name1-(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
PubChem CID161135509
Molecular FormulaC107H173N13O6
Molecular Weight1737.65 g/mol
Exact Mass1736.36
IUPAC Name1-(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
SMILESCN1CCN(c2ccc(C(C)(C)C)cc2)CC1.COc1cc(N2CCC(N(C)C)CC2)ccc1C(C)(C)C.COc1cc(N2CCC(N3CCCC3)CC2)ccc1C(C)(C)C.COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1C(C)(C)C.COc1cc(N2CCN(C)CC2)ccc1C(C)(C)C.COc1cc2c(cc1C(C)(C)C)N(C(=O)CN(C)C)CC2
InChIInChI=1S/C21H35N3O.C20H32N2O.C18H30N2O.C17H26N2O2.C16H26N2O.C15H24N2/c1-21(2,3)19-7-6-18(16-20(19)25-5)23-10-8-17(9-11-23)24-14-12-22(4)13-15-24;1-20(2,3)18-8-7-17(15-19(18)23-4)22-13-9-16(10-14-22)21-11-5-6-12-21;1-18(2,3)16-8-7-15(13-17(16)21-6)20-11-9-14(10-12-20)19(4)5;1-17(2,3)13-10-14-12(9-15(13)21-6)7-8-19(14)16(20)11-18(4)5;1-16(2,3)14-7-6-13(12-15(14)19-5)18-10-8-17(4)9-11-18;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17/h6-7,16-17H,8-15H2,1-5H3;7-8,15-16H,5-6,9-14H2,1-4H3;7-8,13-14H,9-12H2,1-6H3;9-10H,7-8,11H2,1-6H3;6-7,12H,8-11H2,1-5H3;5-8H,9-12H2,1-4H3
InChIKeyUMSWYYXYGMSIOI-UHFFFAOYSA-N
XLogP18.71
TPSA105.34 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds15
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001737.65
LogP ≤ 518.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 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 with MolForge

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Related Compounds

2-(1'-methylspiro[6,7-dihydro-2H-furo[2,3-f]indole-3,4'-piperidine]-5-yl)-1-[4-(2-phenylethyl)piperazin-1-yl]ethanone
CID 15408865
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
Bis(1-(4-tert-butyl-3-methoxyphenyl)-4-methylpiperazine);bis(1-[4-(4-tert-butyl-3-methoxyphenyl)piperazin-1-yl]ethanone)
CID 158963906
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 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CN1CCN(c2ccc(C(C)(C)C)cc2)CC1.COc1cc(N2CCC(N(C)C)CC2)ccc1C(C)(C)C.COc1cc(N2CCC(N3CCCC3)CC2)ccc1C(C)(C)C.COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1C(C)(C)C.COc1cc(N2CCN(C)CC2)ccc1C(C)(C)C.COc1cc2c(cc1C(C)(C)C)N(C(=O)CN(C)C)CC2.
What is the InChIKey of 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?
The InChIKey is UMSWYYXYGMSIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H35N3O.C20H32N2O.C18H30N2O.C17H26N2O2.C16H26N2O.C15H24N2/c1-21(2,3)19-7-6-18(16-20(19)25-5)23-10-8-17(9-11-23)24-14-12-22(4)13-15-24;1-20(2,3)18-8-7-17(15-19(18)23-4)22-13-9-16(10-14-22)21-11-5-6-12-21;1-18(2,3)16-8-7-15(13-17(16)21-6)20-11-9-14(10-12-20)19(4)5;1-17(2,3)13-10-14-12(9-15(13)21-6)7-8-19(14)16(20)11-18(4)5;1-16(2,3)14-7-6-13(12-15(14)19-5)18-10-8-17(4)9-11-18;1-15(2,3)13-5-7-14(8-6-13)17-11-9-16(4)10-12-17/h6-7,16-17H,8-15H2,1-5H3;7-8,15-16H,5-6,9-14H2,1-4H3;7-8,13-14H,9-12H2,1-6H3;9-10H,7-8,11H2,1-6H3;6-7,12H,8-11H2,1-5H3;5-8H,9-12H2,1-4H3.
What are the key properties of 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?
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 has a molecular weight of 1737.65 g/mol, XLogP of 18.71, 15 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 161135509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).