N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine

C146H147N23S6 — CID 159994363

IUPACN-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESCCN(CCc1ccc(Nc2nc(-c3ccccc3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2nc(-c3ccccn3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2nc(-c3cccnc3)cs2)cc1)c1ccccc1.CN(CCc1ccc(Nc2nc(-c3ccncc3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2ncc(-c3cccnc3)s2)cc1)Cc1ccccc1.CN(CCc1ccccc1)CCc1ccc(Nc2nc(-c3cccnc3)cs2)cc1
InChIInChI=1S/C26H27N3S.C25H26N4S.3C24H24N4S.C23H22N4S/c1-2-29(19-22-9-5-3-6-10-22)18-17-21-13-15-24(16-14-21)27-26-28-25(20-30-26)23-11-7-4-8-12-23;1-29(16-13-20-6-3-2-4-7-20)17-14-21-9-11-23(12-10-21)27-25-28-24(19-30-25)22-8-5-15-26-18-22;1-28(17-20-7-3-2-4-8-20)16-14-19-10-12-21(13-11-19)26-24-27-23(18-29-24)22-9-5-6-15-25-22;1-28(18-20-6-3-2-4-7-20)15-13-19-9-11-22(12-10-19)27-24-26-17-23(29-24)21-8-5-14-25-16-21;1-28(17-20-5-3-2-4-6-20)16-13-19-7-9-22(10-8-19)26-24-27-23(18-29-24)21-11-14-25-15-12-21;1-27(21-7-3-2-4-8-21)15-13-18-9-11-20(12-10-18)25-23-26-22(17-28-23)19-6-5-14-24-16-19/h3-16,20H,2,17-19H2,1H3,(H,27,28);2-12,15,18-19H,13-14,16-17H2,1H3,(H,27,28);2-13,15,18H,14,16-17H2,1H3,(H,26,27);2-12,14,16-17H,13,15,18H2,1H3,(H,26,27);2-12,14-15,18H,13,16-17H2,1H3,(H,26,27);2-12,14,16-17H,13,15H2,1H3,(H,25,26)
InChIKeyOHIUHTOUMKKZBQ-UHFFFAOYSA-N
MW2416.34 g/mol
LogP34.78
Rot. Bonds49

About N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine

N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine (PubChem CID 159994363) has the molecular formula C146H147N23S6 and a molecular weight of 2416.34 g/mol. Its IUPAC name is N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
PubChem CID159994363
Molecular FormulaC146H147N23S6
Molecular Weight2416.34 g/mol
Exact Mass2414.05
IUPAC NameN-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESCCN(CCc1ccc(Nc2nc(-c3ccccc3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2nc(-c3ccccn3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2nc(-c3cccnc3)cs2)cc1)c1ccccc1.CN(CCc1ccc(Nc2nc(-c3ccncc3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2ncc(-c3cccnc3)s2)cc1)Cc1ccccc1.CN(CCc1ccccc1)CCc1ccc(Nc2nc(-c3cccnc3)cs2)cc1
InChIInChI=1S/C26H27N3S.C25H26N4S.3C24H24N4S.C23H22N4S/c1-2-29(19-22-9-5-3-6-10-22)18-17-21-13-15-24(16-14-21)27-26-28-25(20-30-26)23-11-7-4-8-12-23;1-29(16-13-20-6-3-2-4-7-20)17-14-21-9-11-23(12-10-21)27-25-28-24(19-30-25)22-8-5-15-26-18-22;1-28(17-20-7-3-2-4-8-20)16-14-19-10-12-21(13-11-19)26-24-27-23(18-29-24)22-9-5-6-15-25-22;1-28(18-20-6-3-2-4-7-20)15-13-19-9-11-22(12-10-19)27-24-26-17-23(29-24)21-8-5-14-25-16-21;1-28(17-20-5-3-2-4-6-20)16-13-19-7-9-22(10-8-19)26-24-27-23(18-29-24)21-11-14-25-15-12-21;1-27(21-7-3-2-4-8-21)15-13-18-9-11-20(12-10-18)25-23-26-22(17-28-23)19-6-5-14-24-16-19/h3-16,20H,2,17-19H2,1H3,(H,27,28);2-12,15,18-19H,13-14,16-17H2,1H3,(H,27,28);2-13,15,18H,14,16-17H2,1H3,(H,26,27);2-12,14,16-17H,13,15,18H2,1H3,(H,26,27);2-12,14-15,18H,13,16-17H2,1H3,(H,26,27);2-12,14,16-17H,13,15H2,1H3,(H,25,26)
InChIKeyOHIUHTOUMKKZBQ-UHFFFAOYSA-N
XLogP34.78
TPSA233.41 Ų
H-Bond Donors6
H-Bond Acceptors29
Rotatable Bonds49
Heavy Atoms175
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002416.34
LogP ≤ 534.78
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1029

Analyze N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine?
The IUPAC name of N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine (CID 159994363) is N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine is CCN(CCc1ccc(Nc2nc(-c3ccccc3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2nc(-c3ccccn3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2nc(-c3cccnc3)cs2)cc1)c1ccccc1.CN(CCc1ccc(Nc2nc(-c3ccncc3)cs2)cc1)Cc1ccccc1.CN(CCc1ccc(Nc2ncc(-c3cccnc3)s2)cc1)Cc1ccccc1.CN(CCc1ccccc1)CCc1ccc(Nc2nc(-c3cccnc3)cs2)cc1.
What is the InChIKey of N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine?
The InChIKey is OHIUHTOUMKKZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3S.C25H26N4S.3C24H24N4S.C23H22N4S/c1-2-29(19-22-9-5-3-6-10-22)18-17-21-13-15-24(16-14-21)27-26-28-25(20-30-26)23-11-7-4-8-12-23;1-29(16-13-20-6-3-2-4-7-20)17-14-21-9-11-23(12-10-21)27-25-28-24(19-30-25)22-8-5-15-26-18-22;1-28(17-20-7-3-2-4-8-20)16-14-19-10-12-21(13-11-19)26-24-27-23(18-29-24)22-9-5-6-15-25-22;1-28(18-20-6-3-2-4-7-20)15-13-19-9-11-22(12-10-19)27-24-26-17-23(29-24)21-8-5-14-25-16-21;1-28(17-20-5-3-2-4-6-20)16-13-19-7-9-22(10-8-19)26-24-27-23(18-29-24)21-11-14-25-15-12-21;1-27(21-7-3-2-4-8-21)15-13-18-9-11-20(12-10-18)25-23-26-22(17-28-23)19-6-5-14-24-16-19/h3-16,20H,2,17-19H2,1H3,(H,27,28);2-12,15,18-19H,13-14,16-17H2,1H3,(H,27,28);2-13,15,18H,14,16-17H2,1H3,(H,26,27);2-12,14,16-17H,13,15,18H2,1H3,(H,26,27);2-12,14-15,18H,13,16-17H2,1H3,(H,26,27);2-12,14,16-17H,13,15H2,1H3,(H,25,26).
What are the key properties of N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine?
N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine has a molecular weight of 2416.34 g/mol, XLogP of 34.78, 49 rotatable bonds, 6 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-[benzyl(ethyl)amino]ethyl]phenyl]-4-phenyl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-4-pyridin-4-yl-1,3-thiazol-2-amine;N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-(N-methylanilino)ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine;N-[4-[2-[methyl(2-phenylethyl)amino]ethyl]phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 159994363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).