1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one

C16H18F3N3O2 — CID 56815790

IUPAC1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one
SMILESO=C(CN(Cc1ccccc1C(F)(F)F)C1CC1)N1CCNC1=O
InChIInChI=1S/C16H18F3N3O2/c17-16(18,19)13-4-2-1-3-11(13)9-21(12-5-6-12)10-14(23)22-8-7-20-15(22)24/h1-4,12H,5-10H2,(H,20,24)
InChIKeyAMQQWLTULTZGBI-UHFFFAOYSA-N
MW341.33 g/mol
LogP2.22
Rot. Bonds5

About 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one

1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one (PubChem CID 56815790) has the molecular formula C16H18F3N3O2 and a molecular weight of 341.33 g/mol. Its IUPAC name is 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one
PubChem CID56815790
Molecular FormulaC16H18F3N3O2
Molecular Weight341.33 g/mol
Exact Mass341.14
IUPAC Name1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one
SMILESO=C(CN(Cc1ccccc1C(F)(F)F)C1CC1)N1CCNC1=O
InChIInChI=1S/C16H18F3N3O2/c17-16(18,19)13-4-2-1-3-11(13)9-21(12-5-6-12)10-14(23)22-8-7-20-15(22)24/h1-4,12H,5-10H2,(H,20,24)
InChIKeyAMQQWLTULTZGBI-UHFFFAOYSA-N
XLogP2.22
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.33
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-Imidazolidinedione, 3-(phenylmethyl)-
CID 231959
1-Benzylimidazolidine-2,4,5-trione
CID 562619
N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]pentanamide
CID 4264496
1-[(2-Fluorophenyl)methyl]imidazolidine-2,4,5-trione
CID 2767579
1-Benzylimidazolidine-2,4-dione
CID 2735485
N-cyclopentyl-2-[3-(2-fluorobenzyl)-2-oxoimidazolidin-1-yl]acetamide
CID 4204383
N-cyclopentyl-2-[3-(4-fluorobenzyl)-2-oxoimidazolidin-1-yl]acetamide
CID 4205522
2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide
CID 5034100
2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide
CID 8533440
2-(3-butyl-2,4,5-trioxoimidazolidin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 16195928
2-[benzyl(methyl)amino]-N-(cyclohexylcarbamoyl)acetamide
CID 16308816
N-(S)-Pyrrolidin-3-yl-N-(2-trifluoromethyl-benzyl)-isobutyramide
CID 11602095

Frequently Asked Questions

What is the IUPAC name of 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one (CID 56815790) is 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one is O=C(CN(Cc1ccccc1C(F)(F)F)C1CC1)N1CCNC1=O.
What is the InChIKey of 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one?
The InChIKey is AMQQWLTULTZGBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18F3N3O2/c17-16(18,19)13-4-2-1-3-11(13)9-21(12-5-6-12)10-14(23)22-8-7-20-15(22)24/h1-4,12H,5-10H2,(H,20,24).
What are the key properties of 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one?
1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one has a molecular weight of 341.33 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[cyclopropyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetyl]imidazolidin-2-one is sourced from PubChem (CID 56815790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).