N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide

C18H21NO3 — CID 110025911

IUPACN-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide
SMILESCOC(C(=O)NC(CCO)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H21NO3/c1-22-17(15-10-6-3-7-11-15)18(21)19-16(12-13-20)14-8-4-2-5-9-14/h2-11,16-17,20H,12-13H2,1H3,(H,19,21)
InChIKeyYVTVEYIOJOKCNG-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.61
Rot. Bonds7

About N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide

N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide (PubChem CID 110025911) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide.

Molecular Properties

Compound NameN-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide
PubChem CID110025911
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide
SMILESCOC(C(=O)NC(CCO)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H21NO3/c1-22-17(15-10-6-3-7-11-15)18(21)19-16(12-13-20)14-8-4-2-5-9-14/h2-11,16-17,20H,12-13H2,1H3,(H,19,21)
InChIKeyYVTVEYIOJOKCNG-UHFFFAOYSA-N
XLogP2.61
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide 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-phenylethyl)-2-methoxy-2-phenylacetamide
CID 63755766
(2S)-2-[(2-methoxy-2-phenylacetyl)amino]propanoic acid
CID 78986376
N-(3-hydroxy-1-phenylpropyl)-2-sulfanylpropanamide
CID 149225632
(2R)-3-hydroxy-2-[(2-methoxy-2-phenylacetyl)amino]propanoic acid
CID 80750625
N-(1-aminobutan-2-yl)-2-methoxy-2-phenylacetamide
CID 63753357
(2S)-2-methoxy-2-phenyl-N-[(1R)-1-phenylethyl]acetamide
CID 10378386
N-[2-hydroxy-1-(3,4,5-trifluorophenyl)ethyl]-2-methoxy-2-phenylacetamide
CID 110026135
[(1S)-3-hydroxy-1-phenylpropyl]carbamothioic S-acid
CID 142183585
(2R)-N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-2-methoxy-2-phenylacetamide
CID 24955191
N-hydroxy-2-methoxy-2-phenylacetamide
CID 14200442
(2S)-2-[(2-methoxy-2-phenylacetyl)amino]hexanoic acid
CID 107144006
(2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide
CID 70094116

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide?
The IUPAC name of N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide (CID 110025911) is N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide.
What is the SMILES notation for N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide?
The canonical SMILES for N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide is COC(C(=O)NC(CCO)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide?
The InChIKey is YVTVEYIOJOKCNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-22-17(15-10-6-3-7-11-15)18(21)19-16(12-13-20)14-8-4-2-5-9-14/h2-11,16-17,20H,12-13H2,1H3,(H,19,21).
What are the key properties of N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide?
N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide has a molecular weight of 299.37 g/mol, XLogP of 2.61, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide is sourced from PubChem (CID 110025911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).