N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride

C10H14ClFN2O2 — CID 11651718

IUPACN-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride
SMILESCOCC(=O)Nc1ccc(CN)cc1F.Cl
InChIInChI=1S/C10H13FN2O2.ClH/c1-15-6-10(14)13-9-3-2-7(5-12)4-8(9)11;/h2-4H,5-6,12H2,1H3,(H,13,14);1H
InChIKeyZZZGWSPOOYPAGY-UHFFFAOYSA-N
MW248.68 g/mol
LogP1.29
Rot. Bonds4

About N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride

N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride (PubChem CID 11651718) has the molecular formula C10H14ClFN2O2 and a molecular weight of 248.68 g/mol. Its IUPAC name is N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride
PubChem CID11651718
Molecular FormulaC10H14ClFN2O2
Molecular Weight248.68 g/mol
Exact Mass248.07
IUPAC NameN-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride
SMILESCOCC(=O)Nc1ccc(CN)cc1F.Cl
InChIInChI=1S/C10H13FN2O2.ClH/c1-15-6-10(14)13-9-3-2-7(5-12)4-8(9)11;/h2-4H,5-6,12H2,1H3,(H,13,14);1H
InChIKeyZZZGWSPOOYPAGY-UHFFFAOYSA-N
XLogP1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.68
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-fluoro-4-[(3-hydroxypyrrolidin-1-yl)methyl]phenyl]-2-methoxyacetamide
CID 102554121
N-[2-fluoro-4-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]phenyl]-2-methoxyacetamide
CID 99778343
2-[3-(aminomethyl)phenoxy]-N-(4-chloro-2-fluorophenyl)acetamide
CID 106485201
N-(5-amino-4-chloro-2-fluorophenyl)-2-methoxyacetamide
CID 22732316
N-[4-(aminomethyl)-2-fluorophenyl]-2,6-dihydroxybenzamide
CID 107687505
[2-(4-chloro-2-fluoroanilino)-2-oxoethyl] 4-(methoxymethyl)benzoate
CID 7588489
2-(2-aminoethoxy)-N-(2-fluoro-4-methylphenyl)acetamide
CID 79463499
N-[4-(aminomethyl)-2-fluorophenyl]-5-methylfuran-3-carboxamide
CID 114818528
N-(2,4-dichlorophenyl)-2-methoxyacetamide
CID 885676
4,5-difluoro-2-[(2-methoxyacetyl)amino]benzoic acid
CID 62865537
[3-fluoro-4-(propanoylamino)phenyl]methyl N-methylcarbamate
CID 170257650
[2-(2,4-difluoroanilino)-2-oxoethyl] 5-methylfuran-2-carboxylate
CID 2561367

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride?
The IUPAC name of N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride (CID 11651718) is N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride.
What is the SMILES notation for N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride?
The canonical SMILES for N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride is COCC(=O)Nc1ccc(CN)cc1F.Cl.
What is the InChIKey of N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride?
The InChIKey is ZZZGWSPOOYPAGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O2.ClH/c1-15-6-10(14)13-9-3-2-7(5-12)4-8(9)11;/h2-4H,5-6,12H2,1H3,(H,13,14);1H.
What are the key properties of N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride?
N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride has a molecular weight of 248.68 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)-2-fluorophenyl]-2-methoxyacetamide;hydrochloride is sourced from PubChem (CID 11651718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).