N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide

C18H24N4O2S — CID 75362669

IUPACN-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide
SMILESO=C(Cc1csc(N2CCNC2=O)n1)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C18H24N4O2S/c23-15(6-14-10-25-17(20-14)22-2-1-19-16(22)24)21-18-7-11-3-12(8-18)5-13(4-11)9-18/h10-13H,1-9H2,(H,19,24)(H,21,23)
InChIKeyPKGIKXODCRIFHQ-UHFFFAOYSA-N
MW360.48 g/mol
LogP2.30
Rot. Bonds4

About N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide

N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide (PubChem CID 75362669) has the molecular formula C18H24N4O2S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide.

Molecular Properties

Compound NameN-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide
PubChem CID75362669
Molecular FormulaC18H24N4O2S
Molecular Weight360.48 g/mol
Exact Mass360.16
IUPAC NameN-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide
SMILESO=C(Cc1csc(N2CCNC2=O)n1)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C18H24N4O2S/c23-15(6-14-10-25-17(20-14)22-2-1-19-16(22)24)21-18-7-11-3-12(8-18)5-13(4-11)9-18/h10-13H,1-9H2,(H,19,24)(H,21,23)
InChIKeyPKGIKXODCRIFHQ-UHFFFAOYSA-N
XLogP2.30
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide?
The IUPAC name of N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide (CID 75362669) is N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide.
What is the SMILES notation for N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide?
The canonical SMILES for N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide is O=C(Cc1csc(N2CCNC2=O)n1)NC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide?
The InChIKey is PKGIKXODCRIFHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2S/c23-15(6-14-10-25-17(20-14)22-2-1-19-16(22)24)21-18-7-11-3-12(8-18)5-13(4-11)9-18/h10-13H,1-9H2,(H,19,24)(H,21,23).
What are the key properties of N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide?
N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide has a molecular weight of 360.48 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-2-[2-(2-oxoimidazolidin-1-yl)-1,3-thiazol-4-yl]acetamide is sourced from PubChem (CID 75362669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).