4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide

C18H21N3O2S — CID 71861057

IUPAC4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide
SMILESCc1ccc(CCCC(=O)Nc2cccc(N3CCNC3=O)c2)s1
InChIInChI=1S/C18H21N3O2S/c1-13-8-9-16(24-13)6-3-7-17(22)20-14-4-2-5-15(12-14)21-11-10-19-18(21)23/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3,(H,19,23)(H,20,22)
InChIKeyNFEMWLVSJMBWKM-UHFFFAOYSA-N
MW343.45 g/mol
LogP3.55
Rot. Bonds6

About 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide

4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide (PubChem CID 71861057) has the molecular formula C18H21N3O2S and a molecular weight of 343.45 g/mol. Its IUPAC name is 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide.

Molecular Properties

Compound Name4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide
PubChem CID71861057
Molecular FormulaC18H21N3O2S
Molecular Weight343.45 g/mol
Exact Mass343.14
IUPAC Name4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide
SMILESCc1ccc(CCCC(=O)Nc2cccc(N3CCNC3=O)c2)s1
InChIInChI=1S/C18H21N3O2S/c1-13-8-9-16(24-13)6-3-7-17(22)20-14-4-2-5-15(12-14)21-11-10-19-18(21)23/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3,(H,19,23)(H,20,22)
InChIKeyNFEMWLVSJMBWKM-UHFFFAOYSA-N
XLogP3.55
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[(5-methylthiophen-2-yl)methylamino]phenyl]imidazolidin-2-one
CID 43696383
4-(4-chlorophenyl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide
CID 55779261
2,2-dimethyl-N-[4-oxo-4-[3-(2-oxoimidazolidin-1-yl)anilino]butyl]propanamide
CID 55717079
2-(5-methylthiophen-2-yl)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 47072523
N-[3-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 47210940
4-(3,4-dimethylphenyl)-4-oxo-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide
CID 55716802
N-[3-(2-oxoimidazolidin-1-yl)phenyl]-2-thiophen-2-ylacetamide
CID 47036521
N-[4-oxo-4-[3-(2-oxoimidazolidin-1-yl)anilino]butyl]thiophene-2-carboxamide
CID 55719816
(3R)-4,4,4-trifluoro-3-hydroxy-3-methyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide
CID 94799953
3-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 55719879
N-[3-(2-oxoimidazolidin-1-yl)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119727665
3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 55720079

Frequently Asked Questions

What is the IUPAC name of 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide?
The IUPAC name of 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide (CID 71861057) is 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide.
What is the SMILES notation for 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide?
The canonical SMILES for 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide is Cc1ccc(CCCC(=O)Nc2cccc(N3CCNC3=O)c2)s1.
What is the InChIKey of 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide?
The InChIKey is NFEMWLVSJMBWKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2S/c1-13-8-9-16(24-13)6-3-7-17(22)20-14-4-2-5-15(12-14)21-11-10-19-18(21)23/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3,(H,19,23)(H,20,22).
What are the key properties of 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide?
4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide has a molecular weight of 343.45 g/mol, XLogP of 3.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methylthiophen-2-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]butanamide is sourced from PubChem (CID 71861057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).