2-(4-fluoro-2-methoxyanilino)propanamide

C10H13FN2O2 — CID 47165201

IUPAC2-(4-fluoro-2-methoxyanilino)propanamide
SMILESCOc1cc(F)ccc1NC(C)C(N)=O
InChIInChI=1S/C10H13FN2O2/c1-6(10(12)14)13-8-4-3-7(11)5-9(8)15-2/h3-6,13H,1-2H3,(H2,12,14)
InChIKeyRALGUMKDLRAWDV-UHFFFAOYSA-N
MW212.22 g/mol
LogP1.12
Rot. Bonds4

About 2-(4-fluoro-2-methoxyanilino)propanamide

2-(4-fluoro-2-methoxyanilino)propanamide (PubChem CID 47165201) has the molecular formula C10H13FN2O2 and a molecular weight of 212.22 g/mol. Its IUPAC name is 2-(4-fluoro-2-methoxyanilino)propanamide.

Molecular Properties

Compound Name2-(4-fluoro-2-methoxyanilino)propanamide
PubChem CID47165201
Molecular FormulaC10H13FN2O2
Molecular Weight212.22 g/mol
Exact Mass212.10
IUPAC Name2-(4-fluoro-2-methoxyanilino)propanamide
SMILESCOc1cc(F)ccc1NC(C)C(N)=O
InChIInChI=1S/C10H13FN2O2/c1-6(10(12)14)13-8-4-3-7(11)5-9(8)15-2/h3-6,13H,1-2H3,(H2,12,14)
InChIKeyRALGUMKDLRAWDV-UHFFFAOYSA-N
XLogP1.12
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluoro-2-methoxyanilino)butanamide
CID 62900802
2-(2-amino-4-fluoroanilino)propanamide
CID 43545455
2-amino-3-(4-fluoro-2-methoxyanilino)propanamide
CID 103245523
(2R)-2-amino-N-(4-fluoro-2-methoxyphenyl)-3-methylbutanamide
CID 79013529
2-(2-amino-4,5-dimethoxyanilino)propanamide
CID 83001358
N-[(2-chlorophenyl)methyl]-2-(4-fluoro-2-methoxyanilino)propanamide
CID 86928510
2-(4-fluoro-2-methoxyanilino)-2-phenylacetic acid
CID 103245512
(2S)-N-(2,4-difluorophenyl)-2-(2-methoxyanilino)propanamide
CID 9274019
5-fluoro-2-[1-(4-fluoro-2-methoxyanilino)ethyl]phenol
CID 63069226
1-(4-fluoro-2-methoxyphenyl)-2-propan-2-ylguanidine
CID 62381483
3-(4-fluoro-2-methoxyanilino)-2-methyl-3-oxopropanoic acid
CID 114898275
methyl 2-(2-carbamothioyl-4-fluoroanilino)propanoate
CID 63674729

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methoxyanilino)propanamide?
The IUPAC name of 2-(4-fluoro-2-methoxyanilino)propanamide (CID 47165201) is 2-(4-fluoro-2-methoxyanilino)propanamide.
What is the SMILES notation for 2-(4-fluoro-2-methoxyanilino)propanamide?
The canonical SMILES for 2-(4-fluoro-2-methoxyanilino)propanamide is COc1cc(F)ccc1NC(C)C(N)=O.
What is the InChIKey of 2-(4-fluoro-2-methoxyanilino)propanamide?
The InChIKey is RALGUMKDLRAWDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O2/c1-6(10(12)14)13-8-4-3-7(11)5-9(8)15-2/h3-6,13H,1-2H3,(H2,12,14).
What are the key properties of 2-(4-fluoro-2-methoxyanilino)propanamide?
2-(4-fluoro-2-methoxyanilino)propanamide has a molecular weight of 212.22 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methoxyanilino)propanamide is sourced from PubChem (CID 47165201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).