2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide

C18H24N4O3 — CID 119438955

IUPAC2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide
SMILESCCNCc1ccccc1NC(=O)CN1C(=O)NC(C)(C2CC2)C1=O
InChIInChI=1S/C18H24N4O3/c1-3-19-10-12-6-4-5-7-14(12)20-15(23)11-22-16(24)18(2,13-8-9-13)21-17(22)25/h4-7,13,19H,3,8-11H2,1-2H3,(H,20,23)(H,21,25)
InChIKeyIGJJFDVFVVXZEH-UHFFFAOYSA-N
MW344.42 g/mol
LogP1.46
Rot. Bonds7

About 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide

2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide (PubChem CID 119438955) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide
PubChem CID119438955
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide
SMILESCCNCc1ccccc1NC(=O)CN1C(=O)NC(C)(C2CC2)C1=O
InChIInChI=1S/C18H24N4O3/c1-3-19-10-12-6-4-5-7-14(12)20-15(23)11-22-16(24)18(2,13-8-9-13)21-17(22)25/h4-7,13,19H,3,8-11H2,1-2H3,(H,20,23)(H,21,25)
InChIKeyIGJJFDVFVVXZEH-UHFFFAOYSA-N
XLogP1.46
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 51.46
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 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide?
The IUPAC name of 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide (CID 119438955) is 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide?
The canonical SMILES for 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide is CCNCc1ccccc1NC(=O)CN1C(=O)NC(C)(C2CC2)C1=O.
What is the InChIKey of 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide?
The InChIKey is IGJJFDVFVVXZEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-3-19-10-12-6-4-5-7-14(12)20-15(23)11-22-16(24)18(2,13-8-9-13)21-17(22)25/h4-7,13,19H,3,8-11H2,1-2H3,(H,20,23)(H,21,25).
What are the key properties of 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide?
2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide has a molecular weight of 344.42 g/mol, XLogP of 1.46, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(ethylaminomethyl)phenyl]acetamide is sourced from PubChem (CID 119438955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).