N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide

C19H23FN2O2 — CID 51305430

IUPACN-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide
SMILESCN(C)C(CNC(=O)COc1ccc(F)cc1)Cc1ccccc1
InChIInChI=1S/C19H23FN2O2/c1-22(2)17(12-15-6-4-3-5-7-15)13-21-19(23)14-24-18-10-8-16(20)9-11-18/h3-11,17H,12-14H2,1-2H3,(H,21,23)
InChIKeyHZWOKDUGJUIMEM-UHFFFAOYSA-N
MW330.40 g/mol
LogP2.49
Rot. Bonds8

About N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide

N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide (PubChem CID 51305430) has the molecular formula C19H23FN2O2 and a molecular weight of 330.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide
PubChem CID51305430
Molecular FormulaC19H23FN2O2
Molecular Weight330.40 g/mol
Exact Mass330.17
IUPAC NameN-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide
SMILESCN(C)C(CNC(=O)COc1ccc(F)cc1)Cc1ccccc1
InChIInChI=1S/C19H23FN2O2/c1-22(2)17(12-15-6-4-3-5-7-15)13-21-19(23)14-24-18-10-8-16(20)9-11-18/h3-11,17H,12-14H2,1-2H3,(H,21,23)
InChIKeyHZWOKDUGJUIMEM-UHFFFAOYSA-N
XLogP2.49
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-2-(dimethylamino)-3-phenylpropyl]-2-(2-phenylphenoxy)acetamide
CID 8794949
N-[2-(dimethylamino)-3-phenylpropyl]-3-(4-methoxyphenyl)propanamide
CID 51186444
2-(4-fluorophenoxy)-N-[(2R)-3-oxo-1-phenylbutan-2-yl]acetamide
CID 7818065
N-[(2S)-2-(dimethylamino)-2-phenylethyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 2111801
N-[(2S)-2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 39835204
N-[2-(dimethylamino)-3-phenylpropyl]-3,3-dimethylbutanamide
CID 47007668
N-[2-[[2-(dimethylamino)-3-phenylpropyl]amino]-2-oxoethyl]-2-(3-fluorophenyl)acetamide
CID 55787160
2-benzyl-3-[[2-(4-ethoxyphenoxy)acetyl]amino]propanoic acid
CID 119233936
N-[2-(dimethylamino)-3-phenylpropyl]-4-oxo-4-phenylbutanamide
CID 75844778
N-[(4-fluorophenyl)methyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 7478807
N-[1-[[2-(dimethylamino)-3-phenylpropyl]amino]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide
CID 55337367
2-(4-fluorophenoxy)-N-[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]acetamide
CID 110279770

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide?
The IUPAC name of N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide (CID 51305430) is N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide?
The canonical SMILES for N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide is CN(C)C(CNC(=O)COc1ccc(F)cc1)Cc1ccccc1.
What is the InChIKey of N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide?
The InChIKey is HZWOKDUGJUIMEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O2/c1-22(2)17(12-15-6-4-3-5-7-15)13-21-19(23)14-24-18-10-8-16(20)9-11-18/h3-11,17H,12-14H2,1-2H3,(H,21,23).
What are the key properties of N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide?
N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide has a molecular weight of 330.40 g/mol, XLogP of 2.49, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-3-phenylpropyl]-2-(4-fluorophenoxy)acetamide is sourced from PubChem (CID 51305430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).