N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide

C24H24N4O3 — CID 8599891

IUPACN-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide
SMILESCN(CC(=O)NN1C(=O)N[C@@](C)(c2ccccc2)C1=O)Cc1ccc2ccccc2c1
InChIInChI=1S/C24H24N4O3/c1-24(20-10-4-3-5-11-20)22(30)28(23(31)25-24)26-21(29)16-27(2)15-17-12-13-18-8-6-7-9-19(18)14-17/h3-14H,15-16H2,1-2H3,(H,25,31)(H,26,29)/t24-/m0/s1
InChIKeyZHFVWGKOXXNNHQ-DEOSSOPVSA-N
MW416.48 g/mol
LogP2.77
Rot. Bonds6

About N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide

N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide (PubChem CID 8599891) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide
PubChem CID8599891
Molecular FormulaC24H24N4O3
Molecular Weight416.48 g/mol
Exact Mass416.18
IUPAC NameN-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide
SMILESCN(CC(=O)NN1C(=O)N[C@@](C)(c2ccccc2)C1=O)Cc1ccc2ccccc2c1
InChIInChI=1S/C24H24N4O3/c1-24(20-10-4-3-5-11-20)22(30)28(23(31)25-24)26-21(29)16-27(2)15-17-12-13-18-8-6-7-9-19(18)14-17/h3-14H,15-16H2,1-2H3,(H,25,31)(H,26,29)/t24-/m0/s1
InChIKeyZHFVWGKOXXNNHQ-DEOSSOPVSA-N
XLogP2.77
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 52.77
H-Bond Donors ≤ 52
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-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide?
The IUPAC name of N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide (CID 8599891) is N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide is CN(CC(=O)NN1C(=O)N[C@@](C)(c2ccccc2)C1=O)Cc1ccc2ccccc2c1.
What is the InChIKey of N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide?
The InChIKey is ZHFVWGKOXXNNHQ-DEOSSOPVSA-N. The full InChI is InChI=1S/C24H24N4O3/c1-24(20-10-4-3-5-11-20)22(30)28(23(31)25-24)26-21(29)16-27(2)15-17-12-13-18-8-6-7-9-19(18)14-17/h3-14H,15-16H2,1-2H3,(H,25,31)(H,26,29)/t24-/m0/s1.
What are the key properties of N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide?
N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide has a molecular weight of 416.48 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 8599891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).