2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide

C14H23N3O2 — CID 62495396

IUPAC2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C)CCc1ccccc1N
InChIInChI=1S/C14H23N3O2/c1-17(11-14(18)16-8-10-19-2)9-7-12-5-3-4-6-13(12)15/h3-6H,7-11,15H2,1-2H3,(H,16,18)
InChIKeyDNHCFIPRKDRZCQ-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.51
Rot. Bonds8

About 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide

2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide (PubChem CID 62495396) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide
PubChem CID62495396
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C)CCc1ccccc1N
InChIInChI=1S/C14H23N3O2/c1-17(11-14(18)16-8-10-19-2)9-7-12-5-3-4-6-13(12)15/h3-6H,7-11,15H2,1-2H3,(H,16,18)
InChIKeyDNHCFIPRKDRZCQ-UHFFFAOYSA-N
XLogP0.51
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[2-(2-aminophenyl)ethyl-methylamino]-N-methylacetamide
CID 62496408
2-[(2-aminophenyl)methyl-propylamino]-N-(3-methoxypropyl)acetamide
CID 61486088
2-[4-[[[2-(2-methoxyethylamino)-2-oxoethyl]-methylamino]methyl]phenyl]acetic acid
CID 105345852
3-amino-2-[[2-(2-methoxyethylamino)-2-oxoethyl]-methylamino]benzoic acid
CID 115934570
2-[butyl(methyl)amino]-N-(2-methoxyethyl)acetamide
CID 108994026
2-[(2-aminophenyl)methyl-methylamino]-N-(3-methylbutyl)acetamide
CID 61486734
N,N-dibenzyl-4-[[[2-(2-methoxyethylamino)-2-oxoethyl]-methylamino]methyl]benzamide
CID 71063959
2-[(2-hydroxy-3-methoxyphenyl)methyl-methylamino]-N-(2-methoxyethyl)acetamide
CID 82979091
2-[(2-aminophenyl)methyl-methylamino]-N-ethylacetamide
CID 43458547
2-[[2-(2-bromoanilino)-2-oxoethyl]-methylamino]-N-(2-methoxyethyl)acetamide
CID 17436271
2-[2-[[2-(2-cyanoethylamino)-2-oxoethyl]-methylamino]ethyl]benzoic acid
CID 104548748
2-[(4-amino-2-bromophenyl)methyl-methylamino]-N-(2-methoxyethyl)acetamide
CID 54989202

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide (CID 62495396) is 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN(C)CCc1ccccc1N.
What is the InChIKey of 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide?
The InChIKey is DNHCFIPRKDRZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-17(11-14(18)16-8-10-19-2)9-7-12-5-3-4-6-13(12)15/h3-6H,7-11,15H2,1-2H3,(H,16,18).
What are the key properties of 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide?
2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide has a molecular weight of 265.36 g/mol, XLogP of 0.51, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminophenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 62495396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).