N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide

C14H22N2O2 — CID 19165327

IUPACN-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NCCN(C)C)cc1C
InChIInChI=1S/C14H22N2O2/c1-11-5-6-13(9-12(11)2)18-10-14(17)15-7-8-16(3)4/h5-6,9H,7-8,10H2,1-4H3,(H,15,17)
InChIKeyDGOBAFKQEPQLHP-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.36
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide

N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide (PubChem CID 19165327) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide
PubChem CID19165327
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NCCN(C)C)cc1C
InChIInChI=1S/C14H22N2O2/c1-11-5-6-13(9-12(11)2)18-10-14(17)15-7-8-16(3)4/h5-6,9H,7-8,10H2,1-4H3,(H,15,17)
InChIKeyDGOBAFKQEPQLHP-UHFFFAOYSA-N
XLogP1.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethylphenoxy)-N-[8-[[2-(3,4-dimethylphenoxy)acetyl]amino]octyl]acetamide
CID 17233359
N-[2-(dimethylamino)ethyl]-2-quinoxalin-6-yloxyacetamide
CID 51362730
methyl N-[2-[[2-(3,4-dimethylphenoxy)acetyl]amino]ethyl]carbamate
CID 108572647
2-(3,4-dimethylphenoxy)-N-(3-methylbutyl)acetamide
CID 21368057
2-[[2-(3,4-dimethylphenoxy)acetyl]amino]-N-methylacetamide
CID 17404287
2-(3,4-dimethylphenoxy)-N-[2-(3,5-dimethylphenoxy)ethyl]acetamide
CID 19174002
2-(3,4-dimethylphenoxy)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 36904254
2-(4-chloro-3,5-dimethylphenoxy)-N-[3-(dimethylamino)propyl]acetamide
CID 2268369
phenyl N-[2-[[2-(3,4-dimethylphenoxy)acetyl]amino]ethyl]carbamate
CID 108572636
2-(4-chlorophenyl)-N-[2-[[2-(3,4-dimethylphenoxy)acetyl]amino]ethyl]acetamide
CID 108572637
ethyl 4-[[2-(3,4-dimethylphenoxy)acetyl]amino]butanoate
CID 60624626
2-(3,4-dimethylphenoxy)-N-[2-[[2-(2,3-dimethylphenoxy)acetyl]amino]ethyl]acetamide
CID 108541272

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide (CID 19165327) is N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide is Cc1ccc(OCC(=O)NCCN(C)C)cc1C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide?
The InChIKey is DGOBAFKQEPQLHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-5-6-13(9-12(11)2)18-10-14(17)15-7-8-16(3)4/h5-6,9H,7-8,10H2,1-4H3,(H,15,17).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide?
N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide has a molecular weight of 250.34 g/mol, XLogP of 1.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-(3,4-dimethylphenoxy)acetamide is sourced from PubChem (CID 19165327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).