2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide

C14H23N3O4 — CID 115759939

IUPAC2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide
SMILESCN(CC1(O)CCCC1)C(=O)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C14H23N3O4/c1-13(2)11(19)17(12(20)15-13)8-10(18)16(3)9-14(21)6-4-5-7-14/h21H,4-9H2,1-3H3,(H,15,20)
InChIKeyAKFPZVQGOGVGRR-UHFFFAOYSA-N
MW297.35 g/mol
LogP0.08
Rot. Bonds4

About 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide

2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide (PubChem CID 115759939) has the molecular formula C14H23N3O4 and a molecular weight of 297.35 g/mol. Its IUPAC name is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide
PubChem CID115759939
Molecular FormulaC14H23N3O4
Molecular Weight297.35 g/mol
Exact Mass297.17
IUPAC Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide
SMILESCN(CC1(O)CCCC1)C(=O)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C14H23N3O4/c1-13(2)11(19)17(12(20)15-13)8-10(18)16(3)9-14(21)6-4-5-7-14/h21H,4-9H2,1-3H3,(H,15,20)
InChIKeyAKFPZVQGOGVGRR-UHFFFAOYSA-N
XLogP0.08
TPSA89.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[2-[(4S)-4-[(dimethylamino)methyl]-4-hydroxyazepan-1-yl]-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 124977065
N-[2-(dimethylamino)-2-oxoethyl]-2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-methylacetamide
CID 9362019
2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)-N,N-dimethylacetamide
CID 9208145
N-(3-amino-3-sulfanylidenepropyl)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylacetamide
CID 43290764
2-[cyclopropyl-[2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetyl]amino]acetic acid
CID 60827223
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methyl-N-[(3R)-pyrrolidin-3-yl]acetamide
CID 124613840
N-(3-amino-2,2-dimethylpropyl)-2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-methylacetamide
CID 119653106
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide
CID 17453320
N-[(1-hydroxycyclopentyl)methyl]-N-methyl-2-(2-oxopyrimidin-1-yl)acetamide
CID 115760048
2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 9401664
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62518050
2-[3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanoyl-methylamino]acetic acid
CID 43171118

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide?
The IUPAC name of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide (CID 115759939) is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide.
What is the SMILES notation for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide?
The canonical SMILES for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide is CN(CC1(O)CCCC1)C(=O)CN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide?
The InChIKey is AKFPZVQGOGVGRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O4/c1-13(2)11(19)17(12(20)15-13)8-10(18)16(3)9-14(21)6-4-5-7-14/h21H,4-9H2,1-3H3,(H,15,20).
What are the key properties of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide?
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide has a molecular weight of 297.35 g/mol, XLogP of 0.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide is sourced from PubChem (CID 115759939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).