N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide

C14H24N4O4 — CID 7181006

IUPACN-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)NC(=O)NC(C)(C)C)C1=O
InChIInChI=1S/C14H24N4O4/c1-6-14(7-2)10(20)18(12(22)17-14)8-9(19)15-11(21)16-13(3,4)5/h6-8H2,1-5H3,(H,17,22)(H2,15,16,19,21)
InChIKeyFDMHMAKWRIMEDB-UHFFFAOYSA-N
MW312.37 g/mol
LogP0.72
Rot. Bonds4

About N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide

N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide (PubChem CID 7181006) has the molecular formula C14H24N4O4 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
PubChem CID7181006
Molecular FormulaC14H24N4O4
Molecular Weight312.37 g/mol
Exact Mass312.18
IUPAC NameN-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)NC(=O)NC(C)(C)C)C1=O
InChIInChI=1S/C14H24N4O4/c1-6-14(7-2)10(20)18(12(22)17-14)8-9(19)15-11(21)16-13(3,4)5/h6-8H2,1-5H3,(H,17,22)(H2,15,16,19,21)
InChIKeyFDMHMAKWRIMEDB-UHFFFAOYSA-N
XLogP0.72
TPSA107.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide (CID 7181006) is N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide is CCC1(CC)NC(=O)N(CC(=O)NC(=O)NC(C)(C)C)C1=O.
What is the InChIKey of N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The InChIKey is FDMHMAKWRIMEDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O4/c1-6-14(7-2)10(20)18(12(22)17-14)8-9(19)15-11(21)16-13(3,4)5/h6-8H2,1-5H3,(H,17,22)(H2,15,16,19,21).
What are the key properties of N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide?
N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide has a molecular weight of 312.37 g/mol, XLogP of 0.72, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(tert-butylcarbamoyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 7181006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).