N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide

C20H27N3O3 — CID 4883009

IUPACN-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCc1ccc(N2C(=O)N(CC(=O)N(C)C3CCCCC3)C(=O)C2C)cc1
InChIInChI=1S/C20H27N3O3/c1-14-9-11-17(12-10-14)23-15(2)19(25)22(20(23)26)13-18(24)21(3)16-7-5-4-6-8-16/h9-12,15-16H,4-8,13H2,1-3H3
InChIKeyAJBHHXREECYJHW-UHFFFAOYSA-N
MW357.45 g/mol
LogP2.94
Rot. Bonds4

About N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide

N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 4883009) has the molecular formula C20H27N3O3 and a molecular weight of 357.45 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID4883009
Molecular FormulaC20H27N3O3
Molecular Weight357.45 g/mol
Exact Mass357.21
IUPAC NameN-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCc1ccc(N2C(=O)N(CC(=O)N(C)C3CCCCC3)C(=O)C2C)cc1
InChIInChI=1S/C20H27N3O3/c1-14-9-11-17(12-10-14)23-15(2)19(25)22(20(23)26)13-18(24)21(3)16-7-5-4-6-8-16/h9-12,15-16H,4-8,13H2,1-3H3
InChIKeyAJBHHXREECYJHW-UHFFFAOYSA-N
XLogP2.94
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide (CID 4883009) is N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide is Cc1ccc(N2C(=O)N(CC(=O)N(C)C3CCCCC3)C(=O)C2C)cc1.
What is the InChIKey of N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is AJBHHXREECYJHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3/c1-14-9-11-17(12-10-14)23-15(2)19(25)22(20(23)26)13-18(24)21(3)16-7-5-4-6-8-16/h9-12,15-16H,4-8,13H2,1-3H3.
What are the key properties of N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 357.45 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 4883009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).