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

C15H25N3O3 — CID 978120

IUPACN-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide
SMILESCCN1C(=O)[C@H](CC(=O)NC2CCCCC2)N(CC)C1=O
InChIInChI=1S/C15H25N3O3/c1-3-17-12(14(20)18(4-2)15(17)21)10-13(19)16-11-8-6-5-7-9-11/h11-12H,3-10H2,1-2H3,(H,16,19)/t12-/m0/s1
InChIKeyMHIPKFRSNPMULA-LBPRGKRZSA-N
MW295.38 g/mol
LogP1.50
Rot. Bonds5

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

N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide (PubChem CID 978120) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide
PubChem CID978120
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC NameN-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide
SMILESCCN1C(=O)[C@H](CC(=O)NC2CCCCC2)N(CC)C1=O
InChIInChI=1S/C15H25N3O3/c1-3-17-12(14(20)18(4-2)15(17)21)10-13(19)16-11-8-6-5-7-9-11/h11-12H,3-10H2,1-2H3,(H,16,19)/t12-/m0/s1
InChIKeyMHIPKFRSNPMULA-LBPRGKRZSA-N
XLogP1.50
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 51.50
H-Bond Donors ≤ 51
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-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide?
The IUPAC name of N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide (CID 978120) is N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide?
The canonical SMILES for N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide is CCN1C(=O)[C@H](CC(=O)NC2CCCCC2)N(CC)C1=O.
What is the InChIKey of N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide?
The InChIKey is MHIPKFRSNPMULA-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-3-17-12(14(20)18(4-2)15(17)21)10-13(19)16-11-8-6-5-7-9-11/h11-12H,3-10H2,1-2H3,(H,16,19)/t12-/m0/s1.
What are the key properties of N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide?
N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide has a molecular weight of 295.38 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[(4S)-1,3-diethyl-2,5-dioxoimidazolidin-4-yl]acetamide is sourced from PubChem (CID 978120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).