2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide

C22H26N4O3S — CID 110222191

IUPAC2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide
SMILESO=C(CC1NC(=O)N(C2CCCCC2)C1=O)NC(Cc1ccsc1)c1ccccn1
InChIInChI=1S/C22H26N4O3S/c27-20(13-19-21(28)26(22(29)25-19)16-6-2-1-3-7-16)24-18(12-15-9-11-30-14-15)17-8-4-5-10-23-17/h4-5,8-11,14,16,18-19H,1-3,6-7,12-13H2,(H,24,27)(H,25,29)
InChIKeyTVGBOPCRZMTJPQ-UHFFFAOYSA-N
MW426.54 g/mol
LogP3.19
Rot. Bonds7

About 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide

2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide (PubChem CID 110222191) has the molecular formula C22H26N4O3S and a molecular weight of 426.54 g/mol. Its IUPAC name is 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide
PubChem CID110222191
Molecular FormulaC22H26N4O3S
Molecular Weight426.54 g/mol
Exact Mass426.17
IUPAC Name2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide
SMILESO=C(CC1NC(=O)N(C2CCCCC2)C1=O)NC(Cc1ccsc1)c1ccccn1
InChIInChI=1S/C22H26N4O3S/c27-20(13-19-21(28)26(22(29)25-19)16-6-2-1-3-7-16)24-18(12-15-9-11-30-14-15)17-8-4-5-10-23-17/h4-5,8-11,14,16,18-19H,1-3,6-7,12-13H2,(H,24,27)(H,25,29)
InChIKeyTVGBOPCRZMTJPQ-UHFFFAOYSA-N
XLogP3.19
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.54
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

2-[(4R)-1-cyclohexyl-2,5-dioxoimidazolidin-4-yl]-N-[(1S)-1-pyridin-3-yl-2-thiophen-3-ylethyl]acetamide
CID 92570518
N-[(1S)-1-pyridin-2-yl-2-thiophen-3-ylethyl]-2-(1,2,4-triazol-1-yl)acetamide
CID 92577329
2-(3-oxo-1,2-dihydroisoindol-1-yl)-N-[1-(1,3-thiazol-2-yl)-2-thiophen-3-ylethyl]acetamide
CID 46966595
4-(4,6-dimethyl-2-oxopyrimidin-1-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)butanamide
CID 110222194
N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-2-thiophen-3-ylacetamide
CID 125446493
2-[(4R)-1-cyclohexyl-2,5-dioxoimidazolidin-4-yl]-N-(1-methyl-5-phenylimidazol-2-yl)acetamide
CID 93242265
3-(3-methoxy-1,2-oxazol-5-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)propanamide
CID 110222177
2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-[2-(piperidin-1-ylmethyl)phenyl]acetamide
CID 46968942
2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-[2-[4-(dimethylamino)phenyl]ethyl]acetamide
CID 46981421
2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1-pyridin-2-yl-2-thiophen-2-ylethyl)acetamide
CID 110223740
2-(butylamino)-N-(2-phenyl-1-pyridin-2-ylethyl)acetamide;dihydrochloride
CID 21293880
2-[(4R)-1-cyclohexyl-2,5-dioxoimidazolidin-4-yl]-N-(2-propan-2-yl-1,3-benzothiazol-6-yl)acetamide
CID 51591557

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide?
The IUPAC name of 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide (CID 110222191) is 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide.
What is the SMILES notation for 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide?
The canonical SMILES for 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide is O=C(CC1NC(=O)N(C2CCCCC2)C1=O)NC(Cc1ccsc1)c1ccccn1.
What is the InChIKey of 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide?
The InChIKey is TVGBOPCRZMTJPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O3S/c27-20(13-19-21(28)26(22(29)25-19)16-6-2-1-3-7-16)24-18(12-15-9-11-30-14-15)17-8-4-5-10-23-17/h4-5,8-11,14,16,18-19H,1-3,6-7,12-13H2,(H,24,27)(H,25,29).
What are the key properties of 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide?
2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide has a molecular weight of 426.54 g/mol, XLogP of 3.19, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)-N-(1-pyridin-2-yl-2-thiophen-3-ylethyl)acetamide is sourced from PubChem (CID 110222191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).