1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one

C17H16F2N4O2 — CID 75448645

IUPAC1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one
SMILESO=C(CNc1ccccc1Nc1ccc(F)cc1F)N1CCNC1=O
InChIInChI=1S/C17H16F2N4O2/c18-11-5-6-13(12(19)9-11)22-15-4-2-1-3-14(15)21-10-16(24)23-8-7-20-17(23)25/h1-6,9,21-22H,7-8,10H2,(H,20,25)
InChIKeyWCOVEGGRUGGAAX-UHFFFAOYSA-N
MW346.34 g/mol
LogP2.67
Rot. Bonds5

About 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one

1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one (PubChem CID 75448645) has the molecular formula C17H16F2N4O2 and a molecular weight of 346.34 g/mol. Its IUPAC name is 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one
PubChem CID75448645
Molecular FormulaC17H16F2N4O2
Molecular Weight346.34 g/mol
Exact Mass346.12
IUPAC Name1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one
SMILESO=C(CNc1ccccc1Nc1ccc(F)cc1F)N1CCNC1=O
InChIInChI=1S/C17H16F2N4O2/c18-11-5-6-13(12(19)9-11)22-15-4-2-1-3-14(15)21-10-16(24)23-8-7-20-17(23)25/h1-6,9,21-22H,7-8,10H2,(H,20,25)
InChIKeyWCOVEGGRUGGAAX-UHFFFAOYSA-N
XLogP2.67
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.34
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-bromo-2-fluoroanilino)acetyl]imidazolidin-2-one
CID 17457429
2-(2,4-difluoroanilino)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone
CID 109000108
2-(2,4-difluoroanilino)-1-piperidin-1-ylethanone
CID 28582835
[(1R)-1-(2,4-difluorophenyl)ethyl]-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]azanium
CID 9369442
2-(2,4-difluoroanilino)-1-morpholin-4-ylethanone
CID 28582837
1-[2-[3-chloro-2-(2,2-difluoroethylsulfanyl)anilino]acetyl]imidazolidin-2-one
CID 122141138
(3R)-N-[2-(2,4-difluoroanilino)phenyl]-6-oxopiperidine-3-carboxamide
CID 97341230
1-[2-(2-methyl-5-nitroanilino)acetyl]imidazolidin-2-one
CID 26506200
1-[2-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]acetyl]imidazolidin-2-one
CID 34082442
4-(azepan-1-yl)-N,N-diethyl-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzenesulfonamide
CID 167790308
ethyl 4-[2-(2,4-difluoroanilino)acetyl]piperazine-1-carboxylate
CID 109003914
1-[2-[(4-hydroxy-2,2-dimethyl-3,4-dihydrochromen-8-yl)amino]acetyl]imidazolidin-2-one
CID 138020739

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one (CID 75448645) is 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one is O=C(CNc1ccccc1Nc1ccc(F)cc1F)N1CCNC1=O.
What is the InChIKey of 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one?
The InChIKey is WCOVEGGRUGGAAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2N4O2/c18-11-5-6-13(12(19)9-11)22-15-4-2-1-3-14(15)21-10-16(24)23-8-7-20-17(23)25/h1-6,9,21-22H,7-8,10H2,(H,20,25).
What are the key properties of 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one?
1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one has a molecular weight of 346.34 g/mol, XLogP of 2.67, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2,4-difluoroanilino)anilino]acetyl]imidazolidin-2-one is sourced from PubChem (CID 75448645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).