2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride

C12H18ClFN2O2 — CID 119340592

IUPAC2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride
SMILESCCC(CNC(=O)CN)Oc1ccccc1F.Cl
InChIInChI=1S/C12H17FN2O2.ClH/c1-2-9(8-15-12(16)7-14)17-11-6-4-3-5-10(11)13;/h3-6,9H,2,7-8,14H2,1H3,(H,15,16);1H
InChIKeySCAWCGCRVHQEDP-UHFFFAOYSA-N
MW276.74 g/mol
LogP1.48
Rot. Bonds6

About 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride

2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride (PubChem CID 119340592) has the molecular formula C12H18ClFN2O2 and a molecular weight of 276.74 g/mol. Its IUPAC name is 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride
PubChem CID119340592
Molecular FormulaC12H18ClFN2O2
Molecular Weight276.74 g/mol
Exact Mass276.10
IUPAC Name2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride
SMILESCCC(CNC(=O)CN)Oc1ccccc1F.Cl
InChIInChI=1S/C12H17FN2O2.ClH/c1-2-9(8-15-12(16)7-14)17-11-6-4-3-5-10(11)13;/h3-6,9H,2,7-8,14H2,1H3,(H,15,16);1H
InChIKeySCAWCGCRVHQEDP-UHFFFAOYSA-N
XLogP1.48
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.74
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;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

(2S)-2-amino-N-[2-(2-fluorophenoxy)butyl]propanamide;hydrochloride
CID 119340588
N-[2-(2-fluorophenoxy)butyl]-4-(methylamino)butanamide;hydrochloride
CID 119813320
(2S)-2-amino-N-[2-(2-fluorophenoxy)butyl]-3-phenylpropanamide
CID 119340597
N-[2-(2-fluorophenoxy)butyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119813356
3-amino-N-[2-(2-chlorophenoxy)butyl]propanamide
CID 119340532
N-[2-(2-fluorophenoxy)butyl]furan-3-carboxamide
CID 71979262
2-[2-(2-fluorophenoxy)butylcarbamoyl]cyclopropane-1-carboxylic acid
CID 119187038
2,2-difluoro-N-[(2S)-2-(2-fluorophenoxy)butyl]-2-(1-hydroxycyclobutyl)acetamide
CID 97240972
2,2-difluoro-N-[2-(2-fluorophenoxy)butyl]-2-(1-hydroxycyclobutyl)acetamide
CID 75387966
3-amino-N-[2-(2-fluorophenoxy)butyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119813326
3-amino-N-[2-(2-fluorophenoxy)butyl]cyclohexane-1-carboxamide;hydrochloride
CID 119813328
3-(2-fluorophenoxy)pentan-1-amine
CID 43368122

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride (CID 119340592) is 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride is CCC(CNC(=O)CN)Oc1ccccc1F.Cl.
What is the InChIKey of 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride?
The InChIKey is SCAWCGCRVHQEDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O2.ClH/c1-2-9(8-15-12(16)7-14)17-11-6-4-3-5-10(11)13;/h3-6,9H,2,7-8,14H2,1H3,(H,15,16);1H.
What are the key properties of 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride?
2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride has a molecular weight of 276.74 g/mol, XLogP of 1.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-fluorophenoxy)butyl]acetamide;hydrochloride is sourced from PubChem (CID 119340592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).