5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one

C16H25N3OS — CID 83252600

IUPAC5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
SMILESCC(C)CC1NC(c2ccsc2)N(C2CCN(C)C2)C1=O
InChIInChI=1S/C16H25N3OS/c1-11(2)8-14-16(20)19(13-4-6-18(3)9-13)15(17-14)12-5-7-21-10-12/h5,7,10-11,13-15,17H,4,6,8-9H2,1-3H3
InChIKeyUNZQVGSQWDRZLW-UHFFFAOYSA-N
MW307.46 g/mol
LogP2.30
Rot. Bonds4

About 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one

5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83252600) has the molecular formula C16H25N3OS and a molecular weight of 307.46 g/mol. Its IUPAC name is 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83252600
Molecular FormulaC16H25N3OS
Molecular Weight307.46 g/mol
Exact Mass307.17
IUPAC Name5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
SMILESCC(C)CC1NC(c2ccsc2)N(C2CCN(C)C2)C1=O
InChIInChI=1S/C16H25N3OS/c1-11(2)8-14-16(20)19(13-4-6-18(3)9-13)15(17-14)12-5-7-21-10-12/h5,7,10-11,13-15,17H,4,6,8-9H2,1-3H3
InChIKeyUNZQVGSQWDRZLW-UHFFFAOYSA-N
XLogP2.30
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.46
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one with MolForge

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

Launch Full Analysis

Related Compounds

3-cyclopropyl-5-(2-methylpropyl)-2-thiophen-3-ylimidazolidin-4-one
CID 83242971
5-methyl-3-(1-methylpiperidin-4-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83243425
5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83255677
5-ethyl-2-(4-methylphenyl)-3-(1-methylpyrrolidin-3-yl)imidazolidin-4-one
CID 83252752
3-(1,3-dimethylpiperidin-4-yl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
CID 114506900
5-butyl-3-cyclopentyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242915
3-(1-methylpiperidin-3-yl)-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 83247094
5-benzyl-3-cyclopropyl-2-thiophen-3-ylimidazolidin-4-one
CID 83244908
5-butan-2-yl-3-cyclobutyl-2-thiophen-3-ylimidazolidin-4-one
CID 83255478
5-ethyl-3-(1-methylpiperidin-3-yl)-2-phenylimidazolidin-4-one
CID 83247325
5-propan-2-yl-3-(thiolan-3-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 103065506
3-(oxan-3-yl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83263879

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one (CID 83252600) is 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one is CC(C)CC1NC(c2ccsc2)N(C2CCN(C)C2)C1=O.
What is the InChIKey of 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is UNZQVGSQWDRZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3OS/c1-11(2)8-14-16(20)19(13-4-6-18(3)9-13)15(17-14)12-5-7-21-10-12/h5,7,10-11,13-15,17H,4,6,8-9H2,1-3H3.
What are the key properties of 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one?
5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 307.46 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83252600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).