N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide

C18H29N3O3 — CID 9171199

IUPACN-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide
SMILESCCCN(C(=O)CN1C(=O)N[C@H](CC(C)C)C1=O)C1=CCCCC1
InChIInChI=1S/C18H29N3O3/c1-4-10-20(14-8-6-5-7-9-14)16(22)12-21-17(23)15(11-13(2)3)19-18(21)24/h8,13,15H,4-7,9-12H2,1-3H3,(H,19,24)/t15-/m1/s1
InChIKeyUNWGXVVWVASSAP-OAHLLOKOSA-N
MW335.45 g/mol
LogP2.65
Rot. Bonds7

About N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide

N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide (PubChem CID 9171199) has the molecular formula C18H29N3O3 and a molecular weight of 335.45 g/mol. Its IUPAC name is N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide.

Molecular Properties

Compound NameN-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide
PubChem CID9171199
Molecular FormulaC18H29N3O3
Molecular Weight335.45 g/mol
Exact Mass335.22
IUPAC NameN-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide
SMILESCCCN(C(=O)CN1C(=O)N[C@H](CC(C)C)C1=O)C1=CCCCC1
InChIInChI=1S/C18H29N3O3/c1-4-10-20(14-8-6-5-7-9-14)16(22)12-21-17(23)15(11-13(2)3)19-18(21)24/h8,13,15H,4-7,9-12H2,1-3H3,(H,19,24)/t15-/m1/s1
InChIKeyUNWGXVVWVASSAP-OAHLLOKOSA-N
XLogP2.65
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 52.65
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-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide?
The IUPAC name of N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide (CID 9171199) is N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide.
What is the SMILES notation for N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide?
The canonical SMILES for N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide is CCCN(C(=O)CN1C(=O)N[C@H](CC(C)C)C1=O)C1=CCCCC1.
What is the InChIKey of N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide?
The InChIKey is UNWGXVVWVASSAP-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H29N3O3/c1-4-10-20(14-8-6-5-7-9-14)16(22)12-21-17(23)15(11-13(2)3)19-18(21)24/h8,13,15H,4-7,9-12H2,1-3H3,(H,19,24)/t15-/m1/s1.
What are the key properties of N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide?
N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide has a molecular weight of 335.45 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexen-1-yl)-2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide is sourced from PubChem (CID 9171199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).