N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride

C14H20ClFN2O2 — CID 119614047

IUPACN-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride
SMILESCl.NCC(NC(=O)CCOc1ccccc1F)C1CC1
InChIInChI=1S/C14H19FN2O2.ClH/c15-11-3-1-2-4-13(11)19-8-7-14(18)17-12(9-16)10-5-6-10;/h1-4,10,12H,5-9,16H2,(H,17,18);1H
InChIKeyMFTNNUWXXXRWOV-UHFFFAOYSA-N
MW302.78 g/mol
LogP1.87
Rot. Bonds7

About N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride

N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride (PubChem CID 119614047) has the molecular formula C14H20ClFN2O2 and a molecular weight of 302.78 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride
PubChem CID119614047
Molecular FormulaC14H20ClFN2O2
Molecular Weight302.78 g/mol
Exact Mass302.12
IUPAC NameN-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride
SMILESCl.NCC(NC(=O)CCOc1ccccc1F)C1CC1
InChIInChI=1S/C14H19FN2O2.ClH/c15-11-3-1-2-4-13(11)19-8-7-14(18)17-12(9-16)10-5-6-10;/h1-4,10,12H,5-9,16H2,(H,17,18);1H
InChIKeyMFTNNUWXXXRWOV-UHFFFAOYSA-N
XLogP1.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.78
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;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-amino-1-cyclopropylethyl)-3-(4-fluorophenoxy)propanamide;hydrochloride
CID 119614077
N-(2-amino-1-cyclopropylethyl)-4-(2-methylphenoxy)butanamide
CID 119617616
N-(2-amino-1-cyclopropylethyl)-4-(2-chlorophenoxy)butanamide
CID 119617753
N-(2-amino-1-cyclopropylethyl)-3-(2-bromo-4-chlorophenoxy)propanamide;hydrochloride
CID 119613712
N-(2-amino-1-cyclopropylethyl)-3-(2,5-dimethylphenoxy)propanamide
CID 119614777
N-(2-aminoethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride
CID 119382925
methyl 2-[3-(2-fluorophenoxy)propanoylamino]propanoate
CID 60638002
N-(2-amino-1-cyclopropylethyl)-4-(3-fluorophenoxy)butanamide;hydrochloride
CID 119616654
N-(2-amino-1-cyclopropylethyl)-2-(2-methoxyphenoxy)acetamide;hydrochloride
CID 119612699
N-(2-amino-1-cyclopropylethyl)-2-(2,3-difluorophenyl)acetamide;hydrochloride
CID 119616566
N-(2-amino-1-cyclopropylethyl)-4-(3-fluorophenoxy)butanamide
CID 119616655
(2R)-2-[3-(2-fluorophenoxy)propanoylamino]propanoic acid
CID 54990985

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride (CID 119614047) is N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride is Cl.NCC(NC(=O)CCOc1ccccc1F)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride?
The InChIKey is MFTNNUWXXXRWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2.ClH/c15-11-3-1-2-4-13(11)19-8-7-14(18)17-12(9-16)10-5-6-10;/h1-4,10,12H,5-9,16H2,(H,17,18);1H.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride?
N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride has a molecular weight of 302.78 g/mol, XLogP of 1.87, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride is sourced from PubChem (CID 119614047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).