2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide

C19H23FN2O2 — CID 120593918

IUPAC2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide
SMILESCCC(CNC(=O)C(C)(N)c1ccccc1)Oc1cccc(F)c1
InChIInChI=1S/C19H23FN2O2/c1-3-16(24-17-11-7-10-15(20)12-17)13-22-18(23)19(2,21)14-8-5-4-6-9-14/h4-12,16H,3,13,21H2,1-2H3,(H,22,23)
InChIKeyHIXBMXSBEIVZID-UHFFFAOYSA-N
MW330.40 g/mol
LogP2.97
Rot. Bonds7

About 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide

2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide (PubChem CID 120593918) has the molecular formula C19H23FN2O2 and a molecular weight of 330.40 g/mol. Its IUPAC name is 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide
PubChem CID120593918
Molecular FormulaC19H23FN2O2
Molecular Weight330.40 g/mol
Exact Mass330.17
IUPAC Name2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide
SMILESCCC(CNC(=O)C(C)(N)c1ccccc1)Oc1cccc(F)c1
InChIInChI=1S/C19H23FN2O2/c1-3-16(24-17-11-7-10-15(20)12-17)13-22-18(23)19(2,21)14-8-5-4-6-9-14/h4-12,16H,3,13,21H2,1-2H3,(H,22,23)
InChIKeyHIXBMXSBEIVZID-UHFFFAOYSA-N
XLogP2.97
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-(3-fluorophenoxy)butyl]-3-phenylpropanamide;hydrochloride
CID 119952317
2-amino-N-(2-phenoxypropyl)-2-phenylpropanamide
CID 120589356
2-amino-N-(2,2-difluoroethyl)-2-phenylpropanamide
CID 115406878
N-ethyl-3-[[ethylamino-[2-(3-fluorophenoxy)butylamino]methylidene]amino]-2,2-dimethylpropanamide
CID 109476115
2-[[(2-amino-2-phenylpropanoyl)amino]methyl]butanoic acid
CID 65224591
N-ethyl-3-[[N-[2-(3-fluorophenoxy)butyl]-N'-methylcarbamimidoyl]amino]-2,2-dimethylpropanamide
CID 109476113
N-tert-butyl-2-[[ethylamino-[2-(3-fluorophenoxy)butylamino]methylidene]amino]acetamide
CID 109475233
1-[2-(3-fluorophenoxy)butyl]-3-(1-hydroxybutan-2-yl)urea
CID 111974568
N-ethyl-2-(3-fluorophenoxy)butan-1-amine
CID 62459043
1-[2-(3-fluorophenoxy)butyl]-2,3-dimethylguanidine
CID 111970146
N-[(2R)-2-(3-fluorophenoxy)butyl]-3-methyl-1,2-thiazole-4-carboxamide
CID 97255935
1-[2-(3-fluorophenoxy)butyl]-2-methyl-3-(2-methyl-2-methylsulfonylpropyl)guanidine
CID 109475503

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide?
The IUPAC name of 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide (CID 120593918) is 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide is CCC(CNC(=O)C(C)(N)c1ccccc1)Oc1cccc(F)c1.
What is the InChIKey of 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide?
The InChIKey is HIXBMXSBEIVZID-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O2/c1-3-16(24-17-11-7-10-15(20)12-17)13-22-18(23)19(2,21)14-8-5-4-6-9-14/h4-12,16H,3,13,21H2,1-2H3,(H,22,23).
What are the key properties of 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide?
2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide has a molecular weight of 330.40 g/mol, XLogP of 2.97, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(3-fluorophenoxy)butyl]-2-phenylpropanamide is sourced from PubChem (CID 120593918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).