2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide

C10H12F2N2O2 — CID 62783596

IUPAC2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide
SMILESCC(N)(COc1cc(F)cc(F)c1)C(N)=O
InChIInChI=1S/C10H12F2N2O2/c1-10(14,9(13)15)5-16-8-3-6(11)2-7(12)4-8/h2-4H,5,14H2,1H3,(H2,13,15)
InChIKeyPCGXIZYDNSJLHA-UHFFFAOYSA-N
MW230.21 g/mol
LogP0.55
Rot. Bonds4

About 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide

2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide (PubChem CID 62783596) has the molecular formula C10H12F2N2O2 and a molecular weight of 230.21 g/mol. Its IUPAC name is 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide
PubChem CID62783596
Molecular FormulaC10H12F2N2O2
Molecular Weight230.21 g/mol
Exact Mass230.09
IUPAC Name2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide
SMILESCC(N)(COc1cc(F)cc(F)c1)C(N)=O
InChIInChI=1S/C10H12F2N2O2/c1-10(14,9(13)15)5-16-8-3-6(11)2-7(12)4-8/h2-4H,5,14H2,1H3,(H2,13,15)
InChIKeyPCGXIZYDNSJLHA-UHFFFAOYSA-N
XLogP0.55
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.21
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-(3,5-difluorophenoxy)-2-methylpropanoic acid
CID 62785817
2-amino-3-(3-fluoro-4-methylphenoxy)-2-methylpropanamide
CID 107170404
3-(3,5-difluorophenoxy)-2,2-dimethylpropan-1-ol
CID 81217572
1-(3,5-difluorophenoxy)-3,3-dimethylbutan-2-one
CID 62784864
3-(3-fluorophenoxy)-2,2-dimethylpropanamide
CID 82078068
ethyl 2-amino-2-cyclopropyl-3-(3,5-difluorophenoxy)propanoate
CID 63921373
methyl 2-(cyclopropylamino)-3-(3,5-difluorophenoxy)-2-methylpropanoate
CID 62784881
3-(3,5-difluorophenoxy)-2-methyl-2-(propan-2-ylamino)propanoic acid
CID 62786393
2-amino-1-(3,5-difluorophenyl)-2-methylbutan-1-one
CID 116590471
5-(3,5-difluorophenoxy)-2,2-dimethylpentanoic acid
CID 65259869
[3-(2,2-difluoropropoxy)-5-fluorophenyl]methanamine
CID 164885137
3-amino-2-[(3,5-difluorophenyl)methyl]-2-methyl-3-oxopropanoic acid
CID 105411814

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide?
The IUPAC name of 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide (CID 62783596) is 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide.
What is the SMILES notation for 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide?
The canonical SMILES for 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide is CC(N)(COc1cc(F)cc(F)c1)C(N)=O.
What is the InChIKey of 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide?
The InChIKey is PCGXIZYDNSJLHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O2/c1-10(14,9(13)15)5-16-8-3-6(11)2-7(12)4-8/h2-4H,5,14H2,1H3,(H2,13,15).
What are the key properties of 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide?
2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide has a molecular weight of 230.21 g/mol, XLogP of 0.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(3,5-difluorophenoxy)-2-methylpropanamide is sourced from PubChem (CID 62783596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).