N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide

C13H24N4O3 — CID 119639591

IUPACN-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide
SMILESCCC(N)(CC)CNC(=O)CCCN1C(=O)CNC1=O
InChIInChI=1S/C13H24N4O3/c1-3-13(14,4-2)9-16-10(18)6-5-7-17-11(19)8-15-12(17)20/h3-9,14H2,1-2H3,(H,15,20)(H,16,18)
InChIKeyHSDJZVQTGMTLFK-UHFFFAOYSA-N
MW284.36 g/mol
LogP-0.05
Rot. Bonds8

About N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide

N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide (PubChem CID 119639591) has the molecular formula C13H24N4O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide
PubChem CID119639591
Molecular FormulaC13H24N4O3
Molecular Weight284.36 g/mol
Exact Mass284.18
IUPAC NameN-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide
SMILESCCC(N)(CC)CNC(=O)CCCN1C(=O)CNC1=O
InChIInChI=1S/C13H24N4O3/c1-3-13(14,4-2)9-16-10(18)6-5-7-17-11(19)8-15-12(17)20/h3-9,14H2,1-2H3,(H,15,20)(H,16,18)
InChIKeyHSDJZVQTGMTLFK-UHFFFAOYSA-N
XLogP-0.05
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 5-0.05
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-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide (CID 119639591) is N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide is CCC(N)(CC)CNC(=O)CCCN1C(=O)CNC1=O.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide?
The InChIKey is HSDJZVQTGMTLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O3/c1-3-13(14,4-2)9-16-10(18)6-5-7-17-11(19)8-15-12(17)20/h3-9,14H2,1-2H3,(H,15,20)(H,16,18).
What are the key properties of N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide?
N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide has a molecular weight of 284.36 g/mol, XLogP of -0.05, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-4-(2,5-dioxoimidazolidin-1-yl)butanamide is sourced from PubChem (CID 119639591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).