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

C16H27N3O3 — CID 4520677

IUPACN-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCC(C)CC1NC(=O)N(CC(=O)N(C)C2CCCCC2)C1=O
InChIInChI=1S/C16H27N3O3/c1-11(2)9-13-15(21)19(16(22)17-13)10-14(20)18(3)12-7-5-4-6-8-12/h11-13H,4-10H2,1-3H3,(H,17,22)
InChIKeyIYTLDENWVSELQK-UHFFFAOYSA-N
MW309.41 g/mol
LogP1.74
Rot. Bonds5

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

N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 4520677) has the molecular formula C16H27N3O3 and a molecular weight of 309.41 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID4520677
Molecular FormulaC16H27N3O3
Molecular Weight309.41 g/mol
Exact Mass309.21
IUPAC NameN-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCC(C)CC1NC(=O)N(CC(=O)N(C)C2CCCCC2)C1=O
InChIInChI=1S/C16H27N3O3/c1-11(2)9-13-15(21)19(16(22)17-13)10-14(20)18(3)12-7-5-4-6-8-12/h11-13H,4-10H2,1-3H3,(H,17,22)
InChIKeyIYTLDENWVSELQK-UHFFFAOYSA-N
XLogP1.74
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 41411898
N-cyclohexyl-2-[4-(1H-indol-3-ylmethyl)-2,5-dioxoimidazolidin-1-yl]-N-methylacetamide
CID 47003752
N-cyclohexyl-2-[(4S)-4-(1H-indol-3-ylmethyl)-2,5-dioxoimidazolidin-1-yl]-N-methylacetamide
CID 51420730
N-benzyl-N-methyl-2-[(4S)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2704236
N-cyclopentyl-2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-methylacetamide
CID 42923084
N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide
CID 9171199
(5S)-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 6601758
N-tert-butyl-2-[(4S)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2604804
N-cyclohexyl-2-[(1R,2S,6S,7R,8S,9R)-8,9-dibromo-3,5-dioxo-4-azatricyclo[5.2.1.02,6]decan-4-yl]-N-methylacetamide
CID 98338532
2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide
CID 51565159
2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 3643364
N,N-dimethyl-4-[[2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]benzamide
CID 24605915

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide (CID 4520677) is N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide is CC(C)CC1NC(=O)N(CC(=O)N(C)C2CCCCC2)C1=O.
What is the InChIKey of N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is IYTLDENWVSELQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O3/c1-11(2)9-13-15(21)19(16(22)17-13)10-14(20)18(3)12-7-5-4-6-8-12/h11-13H,4-10H2,1-3H3,(H,17,22).
What are the key properties of N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 309.41 g/mol, XLogP of 1.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 4520677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).