N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide

C18H19N5O3S — CID 75271275

IUPACN-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide
SMILESO=C1CCN(CCC(=O)Nc2cccc(-c3cn4c(n3)SCC4)c2)C(=O)N1
InChIInChI=1S/C18H19N5O3S/c24-15(4-6-22-7-5-16(25)21-17(22)26)19-13-3-1-2-12(10-13)14-11-23-8-9-27-18(23)20-14/h1-3,10-11H,4-9H2,(H,19,24)(H,21,25,26)
InChIKeyUMJDLNRCXGYVKP-UHFFFAOYSA-N
MW385.45 g/mol
LogP1.93
Rot. Bonds5

About N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide

N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide (PubChem CID 75271275) has the molecular formula C18H19N5O3S and a molecular weight of 385.45 g/mol. Its IUPAC name is N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide.

Molecular Properties

Compound NameN-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide
PubChem CID75271275
Molecular FormulaC18H19N5O3S
Molecular Weight385.45 g/mol
Exact Mass385.12
IUPAC NameN-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide
SMILESO=C1CCN(CCC(=O)Nc2cccc(-c3cn4c(n3)SCC4)c2)C(=O)N1
InChIInChI=1S/C18H19N5O3S/c24-15(4-6-22-7-5-16(25)21-17(22)26)19-13-3-1-2-12(10-13)14-11-23-8-9-27-18(23)20-14/h1-3,10-11H,4-9H2,(H,19,24)(H,21,25,26)
InChIKeyUMJDLNRCXGYVKP-UHFFFAOYSA-N
XLogP1.93
TPSA96.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.45
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-phenylacetamide
CID 40506211
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide
CID 40506262
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 121031186
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(2-methylphenyl)acetamide
CID 121031113
2-(3-bromophenyl)-N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]acetamide
CID 40506227
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 121031180
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 121031083
4-chloro-N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-nitrobenzamide
CID 40506251
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-methyl-4-nitrobenzamide
CID 40506233
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(3,5-dimethylphenoxy)propanamide
CID 121031089
3-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)anilino]-1-(2-hydroxyethyl)pyrrole-2,5-dione
CID 168558080
5-chloro-N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxybenzamide
CID 40506234

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide?
The IUPAC name of N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide (CID 75271275) is N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide.
What is the SMILES notation for N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide?
The canonical SMILES for N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide is O=C1CCN(CCC(=O)Nc2cccc(-c3cn4c(n3)SCC4)c2)C(=O)N1.
What is the InChIKey of N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide?
The InChIKey is UMJDLNRCXGYVKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O3S/c24-15(4-6-22-7-5-16(25)21-17(22)26)19-13-3-1-2-12(10-13)14-11-23-8-9-27-18(23)20-14/h1-3,10-11H,4-9H2,(H,19,24)(H,21,25,26).
What are the key properties of N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide?
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide has a molecular weight of 385.45 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-3-(2,4-dioxo-1,3-diazinan-1-yl)propanamide is sourced from PubChem (CID 75271275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).