6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide

C18H27N3O2 — CID 2974150

IUPAC6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide
SMILESCC1NC(=O)NC1CCCCCC(=O)NCCc1ccccc1
InChIInChI=1S/C18H27N3O2/c1-14-16(21-18(23)20-14)10-6-3-7-11-17(22)19-13-12-15-8-4-2-5-9-15/h2,4-5,8-9,14,16H,3,6-7,10-13H2,1H3,(H,19,22)(H2,20,21,23)
InChIKeyZUWQXYDMMUZDNB-UHFFFAOYSA-N
MW317.43 g/mol
LogP2.37
Rot. Bonds9

About 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide

6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide (PubChem CID 2974150) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide.

Molecular Properties

Compound Name6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide
PubChem CID2974150
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC Name6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide
SMILESCC1NC(=O)NC1CCCCCC(=O)NCCc1ccccc1
InChIInChI=1S/C18H27N3O2/c1-14-16(21-18(23)20-14)10-6-3-7-11-17(22)19-13-12-15-8-4-2-5-9-15/h2,4-5,8-9,14,16H,3,6-7,10-13H2,1H3,(H,19,22)(H2,20,21,23)
InChIKeyZUWQXYDMMUZDNB-UHFFFAOYSA-N
XLogP2.37
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide?
The IUPAC name of 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide (CID 2974150) is 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide.
What is the SMILES notation for 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide?
The canonical SMILES for 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide is CC1NC(=O)NC1CCCCCC(=O)NCCc1ccccc1.
What is the InChIKey of 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide?
The InChIKey is ZUWQXYDMMUZDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-14-16(21-18(23)20-14)10-6-3-7-11-17(22)19-13-12-15-8-4-2-5-9-15/h2,4-5,8-9,14,16H,3,6-7,10-13H2,1H3,(H,19,22)(H2,20,21,23).
What are the key properties of 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide?
6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide has a molecular weight of 317.43 g/mol, XLogP of 2.37, 9 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methyl-2-oxoimidazolidin-4-yl)-N-(2-phenylethyl)hexanamide is sourced from PubChem (CID 2974150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).