1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one

C14H17F2N3O2 — CID 56815809

IUPAC1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one
SMILESCC(c1cc(F)ccc1F)N(C)CC(=O)N1CCNC1=O
InChIInChI=1S/C14H17F2N3O2/c1-9(11-7-10(15)3-4-12(11)16)18(2)8-13(20)19-6-5-17-14(19)21/h3-4,7,9H,5-6,8H2,1-2H3,(H,17,21)
InChIKeyPRNPNODPWXENAU-UHFFFAOYSA-N
MW297.30 g/mol
LogP1.51
Rot. Bonds4

About 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one

1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one (PubChem CID 56815809) has the molecular formula C14H17F2N3O2 and a molecular weight of 297.30 g/mol. Its IUPAC name is 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one
PubChem CID56815809
Molecular FormulaC14H17F2N3O2
Molecular Weight297.30 g/mol
Exact Mass297.13
IUPAC Name1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one
SMILESCC(c1cc(F)ccc1F)N(C)CC(=O)N1CCNC1=O
InChIInChI=1S/C14H17F2N3O2/c1-9(11-7-10(15)3-4-12(11)16)18(2)8-13(20)19-6-5-17-14(19)21/h3-4,7,9H,5-6,8H2,1-2H3,(H,17,21)
InChIKeyPRNPNODPWXENAU-UHFFFAOYSA-N
XLogP1.51
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.30
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(1R)-1-(2,4-difluorophenyl)ethyl]-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]azanium
CID 9369442
ethyl 2-[[(1R)-1-(2,5-difluorophenyl)ethyl]-methylamino]acetate
CID 94417360
1-[2-[(3-fluorophenyl)methyl-methylamino]acetyl]imidazolidin-2-one
CID 8909124
2-[1-(2,5-difluorophenyl)ethyl-methylamino]-N-propylacetamide
CID 60503075
1-[(2R)-2-(2,5-difluorophenyl)sulfanylpropanoyl]imidazolidin-2-one
CID 9062916
6-amino-5-[2-[[(1S)-1-(2,5-difluorophenyl)ethyl]-methylamino]acetyl]-1-(2-methylpropyl)pyrimidine-2,4-dione
CID 95042652
2-[1-(2-fluorophenyl)ethyl-methylamino]-1-piperazin-1-ylethanone
CID 61018397
2-[1-(2,5-difluorophenyl)ethyl-methylamino]-N-(2-methyl-1,3-dioxoisoindol-5-yl)acetamide
CID 55838586
1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one
CID 94531068
1-[(2S)-2-[[(1R)-1-(2,4-difluorophenyl)ethyl]amino]propanoyl]imidazolidin-2-one
CID 8689076
N-(3-chloro-4-fluorophenyl)-2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetamide
CID 60514650
4-fluoro-3-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylbenzoic acid
CID 80556369

Frequently Asked Questions

What is the IUPAC name of 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one (CID 56815809) is 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one is CC(c1cc(F)ccc1F)N(C)CC(=O)N1CCNC1=O.
What is the InChIKey of 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one?
The InChIKey is PRNPNODPWXENAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2N3O2/c1-9(11-7-10(15)3-4-12(11)16)18(2)8-13(20)19-6-5-17-14(19)21/h3-4,7,9H,5-6,8H2,1-2H3,(H,17,21).
What are the key properties of 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one?
1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one has a molecular weight of 297.30 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one is sourced from PubChem (CID 56815809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).