2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride

C15H25ClN2O2 — CID 119716132

IUPAC2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride
SMILESCOCCNCC(=O)NCc1c(C)cc(C)cc1C.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-11-7-12(2)14(13(3)8-11)9-17-15(18)10-16-5-6-19-4;/h7-8,16H,5-6,9-10H2,1-4H3,(H,17,18);1H
InChIKeyIVAXOZKOPWELPC-UHFFFAOYSA-N
MW300.83 g/mol
LogP1.89
Rot. Bonds7

About 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride

2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride (PubChem CID 119716132) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride
PubChem CID119716132
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC Name2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride
SMILESCOCCNCC(=O)NCc1c(C)cc(C)cc1C.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-11-7-12(2)14(13(3)8-11)9-17-15(18)10-16-5-6-19-4;/h7-8,16H,5-6,9-10H2,1-4H3,(H,17,18);1H
InChIKeyIVAXOZKOPWELPC-UHFFFAOYSA-N
XLogP1.89
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.83
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Cambridge id 6878150
CID 2917394
N-(oxolan-2-ylmethyl)-N'-[(4-propan-2-ylphenyl)methyl]oxamide
CID 4314957
N-(2,4,5-Trimethylbenzyl)-acetamide
CID 295549
N-(2-methoxyethyl)-2,4,6-trimethylbenzamide
CID 1568257
(2R)-2-acetamido-3-methoxy-N-[(4-methylphenyl)methyl]propanamide
CID 45486387
(2R)-2-acetamido-3-methoxy-N-[(4-propylphenyl)methyl]propanamide
CID 45486389
(2R)-2-acetamido-N-[(4-ethenylphenyl)methyl]-3-methoxypropanamide
CID 45486468
(2R)-2-acetamido-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide
CID 45486475
Acetamide, N-benzyl-2-morpholino-, hydrochloride
CID 3055386
Acetamide, 2-(propylamino)-N-(alpha,alpha,p-trimethylbenzyl)-
CID 33351
(2,4-Dimethylbenzyl)(2-methoxy-1-methylethyl)amine
CID 2850780
N-(2-Cyclohex-1-enyl-ethyl)-N'-(4-methyl-benzyl)-oxalamide
CID 3117519

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride (CID 119716132) is 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride is COCCNCC(=O)NCc1c(C)cc(C)cc1C.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride?
The InChIKey is IVAXOZKOPWELPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-11-7-12(2)14(13(3)8-11)9-17-15(18)10-16-5-6-19-4;/h7-8,16H,5-6,9-10H2,1-4H3,(H,17,18);1H.
What are the key properties of 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride?
2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 1.89, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 119716132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).