2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide

C15H14FN3O2 — CID 90271537

IUPAC2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C15H14FN3O2/c16-11-5-7-12(8-6-11)18-15(21)19-13-4-2-1-3-10(13)9-14(17)20/h1-8H,9H2,(H2,17,20)(H2,18,19,21)
InChIKeyXFUXMQPPYHZJTP-UHFFFAOYSA-N
MW287.29 g/mol
LogP2.50
Rot. Bonds4

About 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide

2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide (PubChem CID 90271537) has the molecular formula C15H14FN3O2 and a molecular weight of 287.29 g/mol. Its IUPAC name is 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide
PubChem CID90271537
Molecular FormulaC15H14FN3O2
Molecular Weight287.29 g/mol
Exact Mass287.11
IUPAC Name2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C15H14FN3O2/c16-11-5-7-12(8-6-11)18-15(21)19-13-4-2-1-3-10(13)9-14(17)20/h1-8H,9H2,(H2,17,20)(H2,18,19,21)
InChIKeyXFUXMQPPYHZJTP-UHFFFAOYSA-N
XLogP2.50
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 52.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-3-[2-(hydroxymethyl)phenyl]urea
CID 61497811
1-(2-bromophenyl)-3-(4-fluorophenyl)urea
CID 835097
N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide
CID 86929205
1-(2-carbamothioyl-3-fluorophenyl)-3-(4-fluorophenyl)urea
CID 43581005
2-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 47248811
1-(4-fluorophenyl)-3-(2-phenoxyphenyl)urea
CID 971524
2-[2-(benzylcarbamoylamino)phenyl]acetamide
CID 51080430
1-(2-carbamothioyl-3-methylphenyl)-3-(4-fluorophenyl)urea
CID 107798932
1-(2-amino-4-fluorophenyl)-3-(4-fluorophenyl)urea
CID 16777898
N-[2-[[2-(2-amino-2-oxoethyl)phenyl]carbamoylamino]ethyl]-2-methylpropanamide
CID 51080425
N'-(4-fluorophenyl)propanediamide
CID 18174009
1-(4-fluorophenyl)-3-[2-[1-(methylamino)ethyl]phenyl]urea
CID 43508295

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide?
The IUPAC name of 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide (CID 90271537) is 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide.
What is the SMILES notation for 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide?
The canonical SMILES for 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide is NC(=O)Cc1ccccc1NC(=O)Nc1ccc(F)cc1.
What is the InChIKey of 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide?
The InChIKey is XFUXMQPPYHZJTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O2/c16-11-5-7-12(8-6-11)18-15(21)19-13-4-2-1-3-10(13)9-14(17)20/h1-8H,9H2,(H2,17,20)(H2,18,19,21).
What are the key properties of 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide?
2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide has a molecular weight of 287.29 g/mol, XLogP of 2.50, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide is sourced from PubChem (CID 90271537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).