2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide

C18H21FN2O2 — CID 166299453

IUPAC2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1C(N)C(=O)NCC(C)(O)c1cccc(F)c1
InChIInChI=1S/C18H21FN2O2/c1-12-6-3-4-9-15(12)16(20)17(22)21-11-18(2,23)13-7-5-8-14(19)10-13/h3-10,16,23H,11,20H2,1-2H3,(H,21,22)
InChIKeyQLDBGFITUVNBCW-UHFFFAOYSA-N
MW316.38 g/mol
LogP2.16
Rot. Bonds5

About 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide

2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide (PubChem CID 166299453) has the molecular formula C18H21FN2O2 and a molecular weight of 316.38 g/mol. Its IUPAC name is 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide
PubChem CID166299453
Molecular FormulaC18H21FN2O2
Molecular Weight316.38 g/mol
Exact Mass316.16
IUPAC Name2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1C(N)C(=O)NCC(C)(O)c1cccc(F)c1
InChIInChI=1S/C18H21FN2O2/c1-12-6-3-4-9-15(12)16(20)17(22)21-11-18(2,23)13-7-5-8-14(19)10-13/h3-10,16,23H,11,20H2,1-2H3,(H,21,22)
InChIKeyQLDBGFITUVNBCW-UHFFFAOYSA-N
XLogP2.16
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-(2-fluorophenyl)-N-[2-(3-fluorophenyl)-2-methylpropyl]acetamide
CID 166261259
2-(3-fluorophenyl)-1-(propan-2-ylamino)propan-2-ol
CID 62773399
(2S)-2-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]-3-phenylpropanamide
CID 119330600
1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol
CID 62775143
(2S)-2-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]-4-methylpentanamide;hydrochloride
CID 119796151
2-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]-3-methoxypropanamide
CID 120990280
diethyl 2-[1-(3-fluorophenyl)-1-hydroxyethyl]propanedioate
CID 62395295
1-[2-(3-fluorophenyl)ethyl]-3-(2-hydroxy-2-phenylpropyl)urea
CID 111334518
[2-(3-fluorophenyl)-2-methylpropyl]urea
CID 115168840
2-(3-fluorophenyl)-2-hydroxypropanamide
CID 62213418
3-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]butanamide
CID 115154464
2-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]-4-methylsulfonylbutanamide;hydrochloride
CID 119957543

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide (CID 166299453) is 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide is Cc1ccccc1C(N)C(=O)NCC(C)(O)c1cccc(F)c1.
What is the InChIKey of 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide?
The InChIKey is QLDBGFITUVNBCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O2/c1-12-6-3-4-9-15(12)16(20)17(22)21-11-18(2,23)13-7-5-8-14(19)10-13/h3-10,16,23H,11,20H2,1-2H3,(H,21,22).
What are the key properties of 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide?
2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide has a molecular weight of 316.38 g/mol, XLogP of 2.16, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(3-fluorophenyl)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 166299453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).