4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide

C17H16F2N2O4 — CID 8946649

IUPAC4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide
SMILESC[C@@H](Oc1ccc(C(N)=O)cc1)C(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C17H16F2N2O4/c1-10(24-12-8-6-11(7-9-12)15(20)22)16(23)21-13-4-2-3-5-14(13)25-17(18)19/h2-10,17H,1H3,(H2,20,22)(H,21,23)/t10-/m1/s1
InChIKeyRWOMCDYFARLOKM-SNVBAGLBSA-N
MW350.32 g/mol
LogP2.79
Rot. Bonds7

About 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide

4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide (PubChem CID 8946649) has the molecular formula C17H16F2N2O4 and a molecular weight of 350.32 g/mol. Its IUPAC name is 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide.

Molecular Properties

Compound Name4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide
PubChem CID8946649
Molecular FormulaC17H16F2N2O4
Molecular Weight350.32 g/mol
Exact Mass350.11
IUPAC Name4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide
SMILESC[C@@H](Oc1ccc(C(N)=O)cc1)C(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C17H16F2N2O4/c1-10(24-12-8-6-11(7-9-12)15(20)22)16(23)21-13-4-2-3-5-14(13)25-17(18)19/h2-10,17H,1H3,(H2,20,22)(H,21,23)/t10-/m1/s1
InChIKeyRWOMCDYFARLOKM-SNVBAGLBSA-N
XLogP2.79
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.32
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2S)-1-(2-fluoroanilino)-1-oxopropan-2-yl]oxybenzamide
CID 7931375
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 2-(4-methoxyphenoxy)propanoate
CID 55518336
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 2-(4-methylphenoxy)propanoate
CID 46622069
N-[2-(difluoromethoxy)phenyl]-2-[4-(tetrazol-1-yl)phenoxy]propanamide
CID 46633898
[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] (2S)-2-(4-cyanophenoxy)propanoate
CID 8856462
(2S)-2-amino-N-[2-(difluoromethoxy)phenyl]propanamide
CID 61147422
4-[(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl]oxybenzamide
CID 7931427
(2S)-N-[2-(difluoromethoxy)phenyl]-2-(3-methyl-4-nitrophenoxy)propanamide
CID 9384278
2-amino-N-[2-(difluoromethoxy)phenyl]-3-methylbutanamide
CID 43146665
(2R)-2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 925101
4-[4-[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]piperazin-1-yl]benzamide
CID 86969612
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 4-(hydroxymethyl)benzoate
CID 46630049

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide?
The IUPAC name of 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide (CID 8946649) is 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide.
What is the SMILES notation for 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide?
The canonical SMILES for 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide is C[C@@H](Oc1ccc(C(N)=O)cc1)C(=O)Nc1ccccc1OC(F)F.
What is the InChIKey of 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide?
The InChIKey is RWOMCDYFARLOKM-SNVBAGLBSA-N. The full InChI is InChI=1S/C17H16F2N2O4/c1-10(24-12-8-6-11(7-9-12)15(20)22)16(23)21-13-4-2-3-5-14(13)25-17(18)19/h2-10,17H,1H3,(H2,20,22)(H,21,23)/t10-/m1/s1.
What are the key properties of 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide?
4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide has a molecular weight of 350.32 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide is sourced from PubChem (CID 8946649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).