2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide

C20H26N2O3 — CID 111115516

IUPAC2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide
SMILESCCN(C)C(C(=O)NCC(O)c1cccc(OC)c1)c1ccccc1
InChIInChI=1S/C20H26N2O3/c1-4-22(2)19(15-9-6-5-7-10-15)20(24)21-14-18(23)16-11-8-12-17(13-16)25-3/h5-13,18-19,23H,4,14H2,1-3H3,(H,21,24)
InChIKeyOITJQWAORNFZQH-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.54
Rot. Bonds8

About 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide

2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide (PubChem CID 111115516) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide
PubChem CID111115516
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC Name2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide
SMILESCCN(C)C(C(=O)NCC(O)c1cccc(OC)c1)c1ccccc1
InChIInChI=1S/C20H26N2O3/c1-4-22(2)19(15-9-6-5-7-10-15)20(24)21-14-18(23)16-11-8-12-17(13-16)25-3/h5-13,18-19,23H,4,14H2,1-3H3,(H,21,24)
InChIKeyOITJQWAORNFZQH-UHFFFAOYSA-N
XLogP2.54
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]carbamate
CID 110663358
N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-(methylamino)acetamide
CID 119765490
N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]butanamide
CID 112510090
N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-3-(2-methylphenyl)propanamide
CID 110663371
3-(3-chlorophenyl)-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-methylpropanamide
CID 109478503
2-(azepan-1-yl)-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]propanamide
CID 111477458
N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-naphthalen-2-ylacetamide
CID 111115615
N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-(4-methylphenyl)acetamide
CID 110663377
1-(4-ethylphenyl)-3-[2-hydroxy-2-(3-methoxyphenyl)ethyl]urea
CID 111116760
1-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-3-(3-methylpentan-2-yl)urea
CID 111115210
2-amino-N-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 119830994
(2S)-2-(dimethylamino)-N-[2-(3-methoxyphenoxy)ethyl]-2-phenylacetamide
CID 99646106

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide?
The IUPAC name of 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide (CID 111115516) is 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide.
What is the SMILES notation for 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide?
The canonical SMILES for 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide is CCN(C)C(C(=O)NCC(O)c1cccc(OC)c1)c1ccccc1.
What is the InChIKey of 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide?
The InChIKey is OITJQWAORNFZQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-4-22(2)19(15-9-6-5-7-10-15)20(24)21-14-18(23)16-11-8-12-17(13-16)25-3/h5-13,18-19,23H,4,14H2,1-3H3,(H,21,24).
What are the key properties of 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide?
2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide has a molecular weight of 342.44 g/mol, XLogP of 2.54, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methyl)amino]-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 111115516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).