tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine

C90H142BrClN22O11S3 — CID 163983448

About tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine

tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine (PubChem CID 163983448) has the molecular formula C90H142BrClN22O11S3 and a molecular weight of 1919.83 g/mol. Its IUPAC name is tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine.

Molecular Properties

• Compound Name: tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
• PubChem CID: 163983448
• Molecular Formula: C90H142BrClN22O11S3
• Molecular Weight: 1919.83 g/mol
• Exact Mass: 1916.93
• IUPAC Name: tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
• SMILES: CC(C)(C)OC(=O)NCCBr.CC1CN(CCN)CC(C)O1.CC1CN(CCNC(=O)OC(C)(C)C)CC(C)O1.CC1CN(CCNc2cc(N)nc3cc(-c4ccn[nH]4)sc23)CC(C)O1.CC1CN(CCNc2cc(N)nc3cc(-c4ccnn4C4CCCCO4)sc23)CC(C)O1.CC1CNCC(C)O1.Nc1cc(Cl)c2sc(-c3ccnn3C3CCCCO3)cc2n1
• InChI: InChI=1S/C23H32N6O2S.C18H24N6OS.C15H15ClN4OS.C13H26N2O3.C8H18N2O.C7H14BrNO2.C6H13NO/c1-15-13-28(14-16(2)31-15)9-8-25-17-12-21(24)27-18-11-20(32-23(17)18)19-6-7-26-29(19)22-5-3-4-10-30-22;1-11-9-24(10-12(2)25-11)6-5-20-14-8-17(19)22-15-7-16(26-18(14)15)13-3-4-21-23-13;16-9-7-13(17)19-10-8-12(22-15(9)10)11-4-5-18-20(11)14-3-1-2-6-21-14;1-10-8-15(9-11(2)17-10)7-6-14-12(16)18-13(3,4)5;1-7-5-10(4-3-9)6-8(2)11-7;1-7(2,3)11-6(10)9-5-4-8;1-5-3-7-4-6(2)8-5/h6-7,11-12,15-16,22H,3-5,8-10,13-14H2,1-2H3,(H3,24,25,27);3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,21,23)(H3,19,20,22);4-5,7-8,14H,1-3,6H2,(H2,17,19);10-11H,6-9H2,1-5H3,(H,14,16);7-8H,3-6,9H2,1-2H3;4-5H2,1-3H3,(H,9,10);5-7H,3-4H2,1-2H3
• InChIKey: TUGJIAATVFLCBR-UHFFFAOYSA-N
• XLogP: 14.81
• TPSA: 397.39 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 33
• Rotatable Bonds: 20
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1919.83
LogP ≤ 5	14.81
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine?

The IUPAC name of tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine (CID 163983448) is tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine.

What is the SMILES notation for tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine?

The canonical SMILES for tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine is CC(C)(C)OC(=O)NCCBr.CC1CN(CCN)CC(C)O1.CC1CN(CCNC(=O)OC(C)(C)C)CC(C)O1.CC1CN(CCNc2cc(N)nc3cc(-c4ccn[nH]4)sc23)CC(C)O1.CC1CN(CCNc2cc(N)nc3cc(-c4ccnn4C4CCCCO4)sc23)CC(C)O1.CC1CNCC(C)O1.Nc1cc(Cl)c2sc(-c3ccnn3C3CCCCO3)cc2n1.

What is the InChIKey of tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine?

The InChIKey is TUGJIAATVFLCBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N6O2S.C18H24N6OS.C15H15ClN4OS.C13H26N2O3.C8H18N2O.C7H14BrNO2.C6H13NO/c1-15-13-28(14-16(2)31-15)9-8-25-17-12-21(24)27-18-11-20(32-23(17)18)19-6-7-26-29(19)22-5-3-4-10-30-22;1-11-9-24(10-12(2)25-11)6-5-20-14-8-17(19)22-15-7-16(26-18(14)15)13-3-4-21-23-13;16-9-7-13(17)19-10-8-12(22-15(9)10)11-4-5-18-20(11)14-3-1-2-6-21-14;1-10-8-15(9-11(2)17-10)7-6-14-12(16)18-13(3,4)5;1-7-5-10(4-3-9)6-8(2)11-7;1-7(2,3)11-6(10)9-5-4-8;1-5-3-7-4-6(2)8-5/h6-7,11-12,15-16,22H,3-5,8-10,13-14H2,1-2H3,(H3,24,25,27);3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,21,23)(H3,19,20,22);4-5,7-8,14H,1-3,6H2,(H2,17,19);10-11H,6-9H2,1-5H3,(H,14,16);7-8H,3-6,9H2,1-2H3;4-5H2,1-3H3,(H,9,10);5-7H,3-4H2,1-2H3.

What are the key properties of tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine?

tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine has a molecular weight of 1919.83 g/mol, XLogP of 14.81, 20 rotatable bonds, 10 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-(2-bromoethyl)carbamate;tert-butyl N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]carbamate;7-chloro-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridin-5-amine;2,6-dimethylmorpholine;2-(2,6-dimethylmorpholin-4-yl)ethanamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-[2-(oxan-2-yl)pyrazol-3-yl]thieno[3,2-b]pyridine-5,7-diamine;7-N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine is sourced from PubChem (CID 163983448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).