2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide

C19H26FN3O3 — CID 51883733

IUPAC2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
SMILESCCCC1(CCC)NC(=O)N(CC(=O)N[C@H](C)c2ccc(F)cc2)C1=O
InChIInChI=1S/C19H26FN3O3/c1-4-10-19(11-5-2)17(25)23(18(26)22-19)12-16(24)21-13(3)14-6-8-15(20)9-7-14/h6-9,13H,4-5,10-12H2,1-3H3,(H,21,24)(H,22,26)/t13-/m1/s1
InChIKeyCIXLEAMJPSYYFT-CYBMUJFWSA-N
MW363.43 g/mol
LogP2.89
Rot. Bonds8

About 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide

2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide (PubChem CID 51883733) has the molecular formula C19H26FN3O3 and a molecular weight of 363.43 g/mol. Its IUPAC name is 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
PubChem CID51883733
Molecular FormulaC19H26FN3O3
Molecular Weight363.43 g/mol
Exact Mass363.20
IUPAC Name2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
SMILESCCCC1(CCC)NC(=O)N(CC(=O)N[C@H](C)c2ccc(F)cc2)C1=O
InChIInChI=1S/C19H26FN3O3/c1-4-10-19(11-5-2)17(25)23(18(26)22-19)12-16(24)21-13(3)14-6-8-15(20)9-7-14/h6-9,13H,4-5,10-12H2,1-3H3,(H,21,24)(H,22,26)/t13-/m1/s1
InChIKeyCIXLEAMJPSYYFT-CYBMUJFWSA-N
XLogP2.89
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.43
LogP ≤ 52.89
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 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide (CID 51883733) is 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide is CCCC1(CCC)NC(=O)N(CC(=O)N[C@H](C)c2ccc(F)cc2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide?
The InChIKey is CIXLEAMJPSYYFT-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H26FN3O3/c1-4-10-19(11-5-2)17(25)23(18(26)22-19)12-16(24)21-13(3)14-6-8-15(20)9-7-14/h6-9,13H,4-5,10-12H2,1-3H3,(H,21,24)(H,22,26)/t13-/m1/s1.
What are the key properties of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide?
2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide has a molecular weight of 363.43 g/mol, XLogP of 2.89, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 51883733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).