2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide

C15H15F2NO4 — CID 110908743

IUPAC2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide
SMILESCC(Oc1ccc(F)c(F)c1)C(=O)NCC(O)c1ccco1
InChIInChI=1S/C15H15F2NO4/c1-9(22-10-4-5-11(16)12(17)7-10)15(20)18-8-13(19)14-3-2-6-21-14/h2-7,9,13,19H,8H2,1H3,(H,18,20)
InChIKeyBWZSABHVXTZDEH-UHFFFAOYSA-N
MW311.28 g/mol
LogP2.17
Rot. Bonds6

About 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide

2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide (PubChem CID 110908743) has the molecular formula C15H15F2NO4 and a molecular weight of 311.28 g/mol. Its IUPAC name is 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide.

Molecular Properties

Compound Name2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide
PubChem CID110908743
Molecular FormulaC15H15F2NO4
Molecular Weight311.28 g/mol
Exact Mass311.10
IUPAC Name2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide
SMILESCC(Oc1ccc(F)c(F)c1)C(=O)NCC(O)c1ccco1
InChIInChI=1S/C15H15F2NO4/c1-9(22-10-4-5-11(16)12(17)7-10)15(20)18-8-13(19)14-3-2-6-21-14/h2-7,9,13,19H,8H2,1H3,(H,18,20)
InChIKeyBWZSABHVXTZDEH-UHFFFAOYSA-N
XLogP2.17
TPSA71.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.28
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,4-difluorophenoxy)-N-(2-hydroxy-2-phenylethyl)propanamide
CID 51097366
(2S)-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-fluorophenoxy)propanamide
CID 41091288
N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(4-methoxyphenyl)propanamide
CID 111108626
(2S)-N-(cyclopropylmethyl)-2-(3,4-difluorophenoxy)propanamide
CID 95160340
(2S)-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(3,4-dimethylphenoxy)propanamide
CID 26819067
(2R)-N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(3,4-dimethylphenoxy)propanamide
CID 26819070
(2R)-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(3,4-dimethylphenoxy)propanamide
CID 26819063
2-(3,4-difluorophenoxy)-N-[3-(methylamino)propyl]propanamide;hydrochloride
CID 119430409
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(3-methyl-4-propan-2-ylphenoxy)propanamide
CID 55787034
methyl 4-fluoro-3-[[2-(furan-2-yl)-2-hydroxyethyl]carbamoylamino]benzoate
CID 78879195
(2S)-2-(4-fluorophenoxy)-N-(furan-2-ylmethyl)propanamide
CID 26909573
(2R)-N-(benzylcarbamoyl)-2-(3,4-difluorophenoxy)propanamide
CID 8578127

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide?
The IUPAC name of 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide (CID 110908743) is 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide.
What is the SMILES notation for 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide?
The canonical SMILES for 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide is CC(Oc1ccc(F)c(F)c1)C(=O)NCC(O)c1ccco1.
What is the InChIKey of 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide?
The InChIKey is BWZSABHVXTZDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO4/c1-9(22-10-4-5-11(16)12(17)7-10)15(20)18-8-13(19)14-3-2-6-21-14/h2-7,9,13,19H,8H2,1H3,(H,18,20).
What are the key properties of 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide?
2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide has a molecular weight of 311.28 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]propanamide is sourced from PubChem (CID 110908743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).