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

C18H21Cl2N3O3 — CID 3433631

IUPACN-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCC1(c2ccc(Cl)cc2Cl)NC(=O)N(CC(=O)NC2CCCCC2)C1=O
InChIInChI=1S/C18H21Cl2N3O3/c1-18(13-8-7-11(19)9-14(13)20)16(25)23(17(26)22-18)10-15(24)21-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,21,24)(H,22,26)
InChIKeySNYNQRVRORXMBV-UHFFFAOYSA-N
MW398.29 g/mol
LogP3.21
Rot. Bonds4

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

N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 3433631) has the molecular formula C18H21Cl2N3O3 and a molecular weight of 398.29 g/mol. Its IUPAC name is N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID3433631
Molecular FormulaC18H21Cl2N3O3
Molecular Weight398.29 g/mol
Exact Mass397.10
IUPAC NameN-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCC1(c2ccc(Cl)cc2Cl)NC(=O)N(CC(=O)NC2CCCCC2)C1=O
InChIInChI=1S/C18H21Cl2N3O3/c1-18(13-8-7-11(19)9-14(13)20)16(25)23(17(26)22-18)10-15(24)21-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,21,24)(H,22,26)
InChIKeySNYNQRVRORXMBV-UHFFFAOYSA-N
XLogP3.21
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.29
LogP ≤ 53.21
H-Bond Donors ≤ 52
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-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (CID 3433631) is N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is CC1(c2ccc(Cl)cc2Cl)NC(=O)N(CC(=O)NC2CCCCC2)C1=O.
What is the InChIKey of N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is SNYNQRVRORXMBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21Cl2N3O3/c1-18(13-8-7-11(19)9-14(13)20)16(25)23(17(26)22-18)10-15(24)21-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,21,24)(H,22,26).
What are the key properties of N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 398.29 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 3433631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).