N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide

C20H24N2O3 — CID 51087801

IUPACN-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide
SMILESCCOc1ccccc1CN(C)C(=O)CNC(=O)Cc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-3-25-18-12-8-7-11-17(18)15-22(2)20(24)14-21-19(23)13-16-9-5-4-6-10-16/h4-12H,3,13-15H2,1-2H3,(H,21,23)
InChIKeyKLXOTLNHLSEWPN-UHFFFAOYSA-N
MW340.42 g/mol
LogP2.40
Rot. Bonds8

About N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide

N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide (PubChem CID 51087801) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide
PubChem CID51087801
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide
SMILESCCOc1ccccc1CN(C)C(=O)CNC(=O)Cc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-3-25-18-12-8-7-11-17(18)15-22(2)20(24)14-21-19(23)13-16-9-5-4-6-10-16/h4-12H,3,13-15H2,1-2H3,(H,21,23)
InChIKeyKLXOTLNHLSEWPN-UHFFFAOYSA-N
XLogP2.40
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-ethoxyphenyl)methyl]-N-methyl-2-(methylamino)acetamide
CID 54873676
2-(cyclopropylamino)-N-[(2-ethoxyphenyl)methyl]-N-methylacetamide
CID 54873700
2-bromo-N-[(2-ethoxyphenyl)methyl]-N-methylacetamide
CID 63678589
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-2-(4-bromophenyl)acetamide
CID 112992420
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-2-(2-bromophenyl)acetamide
CID 112992422
3,4-diethoxy-N-[2-[methyl-[[2-(trifluoromethoxy)phenyl]methyl]amino]-2-oxoethyl]benzamide
CID 38073078
N-[(2-ethoxyphenyl)methyl]-4-hydroxy-N-methylbutanamide
CID 79200511
2-[benzenesulfonyl(methyl)amino]-N-[(2-ethoxyphenyl)methyl]-N-methylacetamide
CID 55957400
2-amino-N-[(2-ethoxyphenyl)methyl]-N-methyl-2-phenylpropanamide;hydrochloride
CID 120589610
N-[(4-ethoxyphenyl)methyl]-N-methyl-3-[(2-phenylacetyl)amino]propanamide
CID 43039190
3-(cyclopropylamino)-N-[(2-ethoxyphenyl)methyl]-N-methylpropanamide
CID 60962807
N-[(2-ethoxyphenyl)methyl]-N-methyl-2-[3-(trifluoromethyl)anilino]acetamide
CID 56546555

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide?
The IUPAC name of N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide (CID 51087801) is N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide is CCOc1ccccc1CN(C)C(=O)CNC(=O)Cc1ccccc1.
What is the InChIKey of N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide?
The InChIKey is KLXOTLNHLSEWPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-3-25-18-12-8-7-11-17(18)15-22(2)20(24)14-21-19(23)13-16-9-5-4-6-10-16/h4-12H,3,13-15H2,1-2H3,(H,21,23).
What are the key properties of N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide?
N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide has a molecular weight of 340.42 g/mol, XLogP of 2.40, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-phenylacetamide is sourced from PubChem (CID 51087801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).