2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide

C14H14F2N2O2 — CID 43088700

IUPAC2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide
SMILESCC(Nc1ccc(F)cc1F)C(=O)NCc1ccco1
InChIInChI=1S/C14H14F2N2O2/c1-9(14(19)17-8-11-3-2-6-20-11)18-13-5-4-10(15)7-12(13)16/h2-7,9,18H,8H2,1H3,(H,17,19)
InChIKeyDSOWZHINXKERBX-UHFFFAOYSA-N
MW280.27 g/mol
LogP2.67
Rot. Bonds5

About 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide

2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide (PubChem CID 43088700) has the molecular formula C14H14F2N2O2 and a molecular weight of 280.27 g/mol. Its IUPAC name is 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide
PubChem CID43088700
Molecular FormulaC14H14F2N2O2
Molecular Weight280.27 g/mol
Exact Mass280.10
IUPAC Name2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide
SMILESCC(Nc1ccc(F)cc1F)C(=O)NCc1ccco1
InChIInChI=1S/C14H14F2N2O2/c1-9(14(19)17-8-11-3-2-6-20-11)18-13-5-4-10(15)7-12(13)16/h2-7,9,18H,8H2,1H3,(H,17,19)
InChIKeyDSOWZHINXKERBX-UHFFFAOYSA-N
XLogP2.67
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.27
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluoroanilino)-N-(furan-2-ylmethyl)propanamide
CID 43088644
2-(2-fluoro-5-methylanilino)-N-(furan-2-ylmethyl)propanamide
CID 43088873
2-(4-chloro-3-fluoroanilino)-N-(furan-2-ylmethyl)propanamide
CID 61470316
2-chloro-4-fluoro-N-[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]benzamide
CID 94811663
2-chloro-4-fluoro-N-[(2R)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]benzamide
CID 94811664
N-(furan-2-ylmethyl)-2-[(3,4,5-trifluorophenyl)methylamino]propanamide
CID 119129013
2-(3,5-dichloro-4-fluoroanilino)-N-(furan-2-ylmethyl)propanamide
CID 107573921
(2R)-N-(furan-2-ylmethyl)-2-hydroxypropanamide
CID 93242884
2-[2-(3-fluorophenyl)ethylamino]-N-(furan-2-ylmethyl)propanamide
CID 43401439
5-chloro-2-fluoro-N-[(2R)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]benzamide
CID 94811176
2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964
(2S)-2-(4-fluorophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 26909573

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide (CID 43088700) is 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide is CC(Nc1ccc(F)cc1F)C(=O)NCc1ccco1.
What is the InChIKey of 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide?
The InChIKey is DSOWZHINXKERBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O2/c1-9(14(19)17-8-11-3-2-6-20-11)18-13-5-4-10(15)7-12(13)16/h2-7,9,18H,8H2,1H3,(H,17,19).
What are the key properties of 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide?
2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide has a molecular weight of 280.27 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluoroanilino)-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 43088700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).