N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide

C15H13F2N3O2 — CID 17451179

IUPACN-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide
SMILESO=C(CNC(=O)Nc1ccccc1)Nc1ccc(F)c(F)c1
InChIInChI=1S/C15H13F2N3O2/c16-12-7-6-11(8-13(12)17)19-14(21)9-18-15(22)20-10-4-2-1-3-5-10/h1-8H,9H2,(H,19,21)(H2,18,20,22)
InChIKeyFWRQLKWVBDHCHC-UHFFFAOYSA-N
MW305.28 g/mol
LogP2.72
Rot. Bonds4

About N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide

N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide (PubChem CID 17451179) has the molecular formula C15H13F2N3O2 and a molecular weight of 305.28 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide
PubChem CID17451179
Molecular FormulaC15H13F2N3O2
Molecular Weight305.28 g/mol
Exact Mass305.10
IUPAC NameN-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide
SMILESO=C(CNC(=O)Nc1ccccc1)Nc1ccc(F)c(F)c1
InChIInChI=1S/C15H13F2N3O2/c16-12-7-6-11(8-13(12)17)19-14(21)9-18-15(22)20-10-4-2-1-3-5-10/h1-8H,9H2,(H,19,21)(H2,18,20,22)
InChIKeyFWRQLKWVBDHCHC-UHFFFAOYSA-N
XLogP2.72
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.28
LogP ≤ 52.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3,4-difluorophenyl)carbamoylamino]-N-(3-methylphenyl)acetamide
CID 42663674
2-[(4-chloro-2-fluorophenyl)carbamoylamino]-N-(3,4-difluorophenyl)acetamide
CID 55473015
2-(phenylcarbamoylamino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 770706
2-[(3-chloro-4-fluorophenyl)carbamoylamino]-N-(4-fluorophenyl)acetamide
CID 42766016
2-(benzylcarbamothioylamino)-N-(3,4-difluorophenyl)acetamide
CID 8771439
N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide
CID 18160954
N-[2-(3,4-difluoroanilino)-2-oxoethyl]-2-methylbenzamide
CID 17395084
methyl N-[2-(3,4-difluoroanilino)-2-oxoethyl]carbamate
CID 47129041
ethyl 2-[(3,4-difluorophenyl)carbamoylamino]acetate
CID 17174426
N,N'-bis(3,4-difluorophenyl)propanediamide
CID 108956967
2-[(4-ethylphenyl)carbamoylamino]-N-(3-fluorophenyl)acetamide
CID 772260
1-(3,4-difluorophenyl)-3-[(1-phenylcyclobutyl)methyl]urea
CID 113215039

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide (CID 17451179) is N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide is O=C(CNC(=O)Nc1ccccc1)Nc1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide?
The InChIKey is FWRQLKWVBDHCHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2N3O2/c16-12-7-6-11(8-13(12)17)19-14(21)9-18-15(22)20-10-4-2-1-3-5-10/h1-8H,9H2,(H,19,21)(H2,18,20,22).
What are the key properties of N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide?
N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide has a molecular weight of 305.28 g/mol, XLogP of 2.72, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide is sourced from PubChem (CID 17451179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).