1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea

C17H20N4O2S — CID 95904318

IUPAC1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea
SMILESC[C@@H](CNC(=O)Nc1cccc(N2CCNC2=O)c1)c1ccsc1
InChIInChI=1S/C17H20N4O2S/c1-12(13-5-8-24-11-13)10-19-16(22)20-14-3-2-4-15(9-14)21-7-6-18-17(21)23/h2-5,8-9,11-12H,6-7,10H2,1H3,(H,18,23)(H2,19,20,22)/t12-/m0/s1
InChIKeyNDUXUPCEACOXCG-LBPRGKRZSA-N
MW344.44 g/mol
LogP3.20
Rot. Bonds5

About 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea

1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea (PubChem CID 95904318) has the molecular formula C17H20N4O2S and a molecular weight of 344.44 g/mol. Its IUPAC name is 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea.

Molecular Properties

Compound Name1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea
PubChem CID95904318
Molecular FormulaC17H20N4O2S
Molecular Weight344.44 g/mol
Exact Mass344.13
IUPAC Name1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea
SMILESC[C@@H](CNC(=O)Nc1cccc(N2CCNC2=O)c1)c1ccsc1
InChIInChI=1S/C17H20N4O2S/c1-12(13-5-8-24-11-13)10-19-16(22)20-14-3-2-4-15(9-14)21-7-6-18-17(21)23/h2-5,8-9,11-12H,6-7,10H2,1H3,(H,18,23)(H2,19,20,22)/t12-/m0/s1
InChIKeyNDUXUPCEACOXCG-LBPRGKRZSA-N
XLogP3.20
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 53.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea with MolForge

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Related Compounds

2-methyl-N-[2-[[3-(2-oxoimidazolidin-1-yl)phenyl]carbamoylamino]ethyl]propanamide
CID 47039442
1-[2-(4-fluorophenyl)-2-hydroxyethyl]-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 55738407
1-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 55738090
1-(2-methylprop-2-enyl)-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 100624959
N-[3-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 47210940
2-bromo-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 107903731
1-[[4-[(dimethylamino)methyl]phenyl]methyl]-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 55738130
1-[2-(4-fluorophenyl)-2-hydroxypropyl]-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 154834572
1-[[3-(diethylaminomethyl)phenyl]methyl]-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 55797540
1-(furan-3-ylmethyl)-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 47039430
(2S)-2-(2-methylpropoxy)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 94123689
1-[[2-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
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Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea?
The IUPAC name of 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea (CID 95904318) is 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea.
What is the SMILES notation for 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea?
The canonical SMILES for 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea is C[C@@H](CNC(=O)Nc1cccc(N2CCNC2=O)c1)c1ccsc1.
What is the InChIKey of 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea?
The InChIKey is NDUXUPCEACOXCG-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H20N4O2S/c1-12(13-5-8-24-11-13)10-19-16(22)20-14-3-2-4-15(9-14)21-7-6-18-17(21)23/h2-5,8-9,11-12H,6-7,10H2,1H3,(H,18,23)(H2,19,20,22)/t12-/m0/s1.
What are the key properties of 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea?
1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea has a molecular weight of 344.44 g/mol, XLogP of 3.20, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[(2R)-2-thiophen-3-ylpropyl]urea is sourced from PubChem (CID 95904318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).