3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one

C13H19N3OS — CID 116981815

IUPAC3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one
SMILESCN1C(=O)N(CC2CCNC2)CC1c1cccs1
InChIInChI=1S/C13H19N3OS/c1-15-11(12-3-2-6-18-12)9-16(13(15)17)8-10-4-5-14-7-10/h2-3,6,10-11,14H,4-5,7-9H2,1H3
InChIKeyJDRCZUHLMWPKSM-UHFFFAOYSA-N
MW265.38 g/mol
LogP1.77
Rot. Bonds3

About 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one

3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one (PubChem CID 116981815) has the molecular formula C13H19N3OS and a molecular weight of 265.38 g/mol. Its IUPAC name is 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one
PubChem CID116981815
Molecular FormulaC13H19N3OS
Molecular Weight265.38 g/mol
Exact Mass265.12
IUPAC Name3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one
SMILESCN1C(=O)N(CC2CCNC2)CC1c1cccs1
InChIInChI=1S/C13H19N3OS/c1-15-11(12-3-2-6-18-12)9-16(13(15)17)8-10-4-5-14-7-10/h2-3,6,10-11,14H,4-5,7-9H2,1H3
InChIKeyJDRCZUHLMWPKSM-UHFFFAOYSA-N
XLogP1.77
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-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

Related Compounds

3-methyl-1-(piperidin-3-ylmethyl)-4-(1H-pyrrol-2-yl)imidazolidin-2-one
CID 116981847
3-methyl-1-(2-pyrrolidin-3-ylethyl)-4-(1H-pyrrol-3-yl)imidazolidin-2-one
CID 116982754
4-tert-butyl-3-methyl-1-(piperidin-3-ylmethyl)imidazolidin-2-one
CID 116981844
3-ethyl-4-thiophen-2-ylpiperidine
CID 79320840
(3R,4S)-4-thiophen-2-ylpiperidin-3-ol
CID 69452815
4-(4-bromothiophen-2-yl)-3-methyl-1-pyrrolidin-3-ylimidazolidin-2-one
CID 116981723
1-propyl-4-(pyrrolidin-3-ylmethyl)piperazine-2,5-dione
CID 79942296
4-tert-butyl-1-(pyrrolidin-3-ylmethyl)imidazolidin-2-one
CID 116979101
1-(pyrrolidin-3-ylmethyl)-2-thiophen-2-ylimidazole
CID 62371626
4-methyl-1-(pyrrolidin-3-ylmethyl)-3H-quinoxalin-2-one
CID 117030719
(3-thiophen-2-ylpiperidin-4-yl)methanol
CID 117000504
N-methyl-2-pyrrolidin-3-yl-N-(2-thiophen-2-ylethyl)acetamide
CID 79493806

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one?
The IUPAC name of 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one (CID 116981815) is 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one.
What is the SMILES notation for 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one?
The canonical SMILES for 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one is CN1C(=O)N(CC2CCNC2)CC1c1cccs1.
What is the InChIKey of 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one?
The InChIKey is JDRCZUHLMWPKSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3OS/c1-15-11(12-3-2-6-18-12)9-16(13(15)17)8-10-4-5-14-7-10/h2-3,6,10-11,14H,4-5,7-9H2,1H3.
What are the key properties of 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one?
3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one has a molecular weight of 265.38 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(pyrrolidin-3-ylmethyl)-4-thiophen-2-ylimidazolidin-2-one is sourced from PubChem (CID 116981815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).