N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide

C18H26N4O3S — CID 90525763

IUPACN-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide
SMILESCC1CN(C(=O)CN2CCc3nc(NC(=O)C4CC4)sc3C2)CC(C)O1
InChIInChI=1S/C18H26N4O3S/c1-11-7-22(8-12(2)25-11)16(23)10-21-6-5-14-15(9-21)26-18(19-14)20-17(24)13-3-4-13/h11-13H,3-10H2,1-2H3,(H,19,20,24)
InChIKeyMOBGZCZTJXFVGL-UHFFFAOYSA-N
MW378.50 g/mol
LogP1.49
Rot. Bonds4

About N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide

N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide (PubChem CID 90525763) has the molecular formula C18H26N4O3S and a molecular weight of 378.50 g/mol. Its IUPAC name is N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide
PubChem CID90525763
Molecular FormulaC18H26N4O3S
Molecular Weight378.50 g/mol
Exact Mass378.17
IUPAC NameN-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide
SMILESCC1CN(C(=O)CN2CCc3nc(NC(=O)C4CC4)sc3C2)CC(C)O1
InChIInChI=1S/C18H26N4O3S/c1-11-7-22(8-12(2)25-11)16(23)10-21-6-5-14-15(9-21)26-18(19-14)20-17(24)13-3-4-13/h11-13H,3-10H2,1-2H3,(H,19,20,24)
InChIKeyMOBGZCZTJXFVGL-UHFFFAOYSA-N
XLogP1.49
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.50
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide (CID 90525763) is N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide is CC1CN(C(=O)CN2CCc3nc(NC(=O)C4CC4)sc3C2)CC(C)O1.
What is the InChIKey of N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide?
The InChIKey is MOBGZCZTJXFVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3S/c1-11-7-22(8-12(2)25-11)16(23)10-21-6-5-14-15(9-21)26-18(19-14)20-17(24)13-3-4-13/h11-13H,3-10H2,1-2H3,(H,19,20,24).
What are the key properties of N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide?
N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide has a molecular weight of 378.50 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 90525763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).