1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one

C14H16N4OS — CID 86785219

IUPAC1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one
SMILESO=C1NCCN1Cc1ccccc1NCc1cncs1
InChIInChI=1S/C14H16N4OS/c19-14-16-5-6-18(14)9-11-3-1-2-4-13(11)17-8-12-7-15-10-20-12/h1-4,7,10,17H,5-6,8-9H2,(H,16,19)
InChIKeyGJYPQSBWQFTEQG-UHFFFAOYSA-N
MW288.38 g/mol
LogP2.28
Rot. Bonds5

About 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one

1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one (PubChem CID 86785219) has the molecular formula C14H16N4OS and a molecular weight of 288.38 g/mol. Its IUPAC name is 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one
PubChem CID86785219
Molecular FormulaC14H16N4OS
Molecular Weight288.38 g/mol
Exact Mass288.10
IUPAC Name1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one
SMILESO=C1NCCN1Cc1ccccc1NCc1cncs1
InChIInChI=1S/C14H16N4OS/c19-14-16-5-6-18(14)9-11-3-1-2-4-13(11)17-8-12-7-15-10-20-12/h1-4,7,10,17H,5-6,8-9H2,(H,16,19)
InChIKeyGJYPQSBWQFTEQG-UHFFFAOYSA-N
XLogP2.28
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.38
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one?
The IUPAC name of 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one (CID 86785219) is 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one.
What is the SMILES notation for 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one?
The canonical SMILES for 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one is O=C1NCCN1Cc1ccccc1NCc1cncs1.
What is the InChIKey of 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one?
The InChIKey is GJYPQSBWQFTEQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS/c19-14-16-5-6-18(14)9-11-3-1-2-4-13(11)17-8-12-7-15-10-20-12/h1-4,7,10,17H,5-6,8-9H2,(H,16,19).
What are the key properties of 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one?
1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one has a molecular weight of 288.38 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(1,3-thiazol-5-ylmethylamino)phenyl]methyl]imidazolidin-2-one is sourced from PubChem (CID 86785219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).