N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide

C14H22N2O3 — CID 60641112

IUPACN-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide
SMILESCCNCC(=O)N(C)Cc1ccc(OC)c(OC)c1
InChIInChI=1S/C14H22N2O3/c1-5-15-9-14(17)16(2)10-11-6-7-12(18-3)13(8-11)19-4/h6-8,15H,5,9-10H2,1-4H3
InChIKeySGIWODNKGYEWIU-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.27
Rot. Bonds7

About N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide

N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide (PubChem CID 60641112) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide.

Molecular Properties

Compound NameN-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide
PubChem CID60641112
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide
SMILESCCNCC(=O)N(C)Cc1ccc(OC)c(OC)c1
InChIInChI=1S/C14H22N2O3/c1-5-15-9-14(17)16(2)10-11-6-7-12(18-3)13(8-11)19-4/h6-8,15H,5,9-10H2,1-4H3
InChIKeySGIWODNKGYEWIU-UHFFFAOYSA-N
XLogP1.27
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3,4-dimethoxyphenyl)methyl]-2-hydroxy-N-methylacetamide
CID 14117549
N-benzyl-2-[2-(3,4-dimethoxyphenyl)ethylamino]-N-methylacetamide
CID 108997410
N-[(3,4-dimethoxyphenyl)methyl]-3-(ethylamino)-N-methylbutanamide
CID 62837059
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-ethylphenyl)-N-methylacetamide
CID 100741439
N-[(2,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide
CID 115157957
N-butyl-2-[(3,4-dimethoxyphenyl)methylamino]-N-methylacetamide
CID 109003052
N-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]-2-(2-methoxyethylamino)-N-methylacetamide
CID 119717111
N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-4-(methylamino)butanamide
CID 60937433
3-(ethylamino)-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylpropanamide
CID 62835854
N-(1,3-benzodioxol-5-ylmethyl)-2-(ethylamino)-N-methylacetamide
CID 60685568
N-[(3-hydroxy-4-methoxyphenyl)methyl]-N-methyl-2-(methylamino)acetamide
CID 119744992
2-[(3-ethoxy-4-methoxyphenyl)methylamino]-N-ethyl-N-methylacetamide
CID 104923342

Frequently Asked Questions

What is the IUPAC name of N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide?
The IUPAC name of N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide (CID 60641112) is N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide.
What is the SMILES notation for N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide?
The canonical SMILES for N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide is CCNCC(=O)N(C)Cc1ccc(OC)c(OC)c1.
What is the InChIKey of N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide?
The InChIKey is SGIWODNKGYEWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-5-15-9-14(17)16(2)10-11-6-7-12(18-3)13(8-11)19-4/h6-8,15H,5,9-10H2,1-4H3.
What are the key properties of N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide?
N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide has a molecular weight of 266.34 g/mol, XLogP of 1.27, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide is sourced from PubChem (CID 60641112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).