3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide

C16H13F2N3O2 — CID 110874016

IUPAC3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
SMILESO=C(Nc1cccc(N2CCNC2=O)c1)c1ccc(F)c(F)c1
InChIInChI=1S/C16H13F2N3O2/c17-13-5-4-10(8-14(13)18)15(22)20-11-2-1-3-12(9-11)21-7-6-19-16(21)23/h1-5,8-9H,6-7H2,(H,19,23)(H,20,22)
InChIKeyORRGJBLFXRVERN-UHFFFAOYSA-N
MW317.30 g/mol
LogP2.75
Rot. Bonds3

About 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide

3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide (PubChem CID 110874016) has the molecular formula C16H13F2N3O2 and a molecular weight of 317.30 g/mol. Its IUPAC name is 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
PubChem CID110874016
Molecular FormulaC16H13F2N3O2
Molecular Weight317.30 g/mol
Exact Mass317.10
IUPAC Name3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
SMILESO=C(Nc1cccc(N2CCNC2=O)c1)c1ccc(F)c(F)c1
InChIInChI=1S/C16H13F2N3O2/c17-13-5-4-10(8-14(13)18)15(22)20-11-2-1-3-12(9-11)21-7-6-19-16(21)23/h1-5,8-9H,6-7H2,(H,19,23)(H,20,22)
InChIKeyORRGJBLFXRVERN-UHFFFAOYSA-N
XLogP2.75
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.30
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-difluorophenyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 51298991
4-benzamido-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 55726264
N-[3-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 47210940
3-oxo-N-[3-(2-oxoimidazolidin-1-yl)phenyl]-4H-1,4-benzothiazine-6-carboxamide
CID 55778485
3-(furan-3-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 75392486
4-(2-oxoimidazolidin-1-yl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 110860885
4-[[3-(2-oxoimidazolidin-1-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120672792
4-chloro-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 51299854
7-chloro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 55716894
2-bromo-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 107903731
5-(4-fluorophenyl)-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]thiophene-2-carboxamide
CID 99811761
1-[3-(difluoromethoxy)phenyl]-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 55831507

Frequently Asked Questions

What is the IUPAC name of 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide?
The IUPAC name of 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide (CID 110874016) is 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide?
The canonical SMILES for 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide is O=C(Nc1cccc(N2CCNC2=O)c1)c1ccc(F)c(F)c1.
What is the InChIKey of 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide?
The InChIKey is ORRGJBLFXRVERN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F2N3O2/c17-13-5-4-10(8-14(13)18)15(22)20-11-2-1-3-12(9-11)21-7-6-19-16(21)23/h1-5,8-9H,6-7H2,(H,19,23)(H,20,22).
What are the key properties of 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide?
3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide has a molecular weight of 317.30 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-difluoro-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 110874016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).