2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide

C15H24N2O2 — CID 78787360

IUPAC2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide
SMILESCCN(CC(=O)NCCCOC)Cc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-3-17(12-14-8-5-4-6-9-14)13-15(18)16-10-7-11-19-2/h4-6,8-9H,3,7,10-13H2,1-2H3,(H,16,18)
InChIKeyORUPWUSGSWFLAT-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.66
Rot. Bonds9

About 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide

2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide (PubChem CID 78787360) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide.

Molecular Properties

Compound Name2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide
PubChem CID78787360
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide
SMILESCCN(CC(=O)NCCCOC)Cc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-3-17(12-14-8-5-4-6-9-14)13-15(18)16-10-7-11-19-2/h4-6,8-9H,3,7,10-13H2,1-2H3,(H,16,18)
InChIKeyORUPWUSGSWFLAT-UHFFFAOYSA-N
XLogP1.66
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide
CID 109015351
methyl 3-[[2-[benzyl(ethyl)amino]acetyl]amino]propanoate
CID 78815356
2-[benzyl(ethyl)amino]-N-[[3-(methoxymethyl)phenyl]methyl]acetamide
CID 87012687
2-[benzyl(ethyl)amino]-N-(cyclopropylmethyl)acetamide
CID 134038287
2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 78787355
1-benzyl-3-(3-methoxypropyl)-1-methylurea
CID 108988118
2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-ethylamino]-N-(3-methoxypropyl)acetamide
CID 78827820
2-[(2-aminophenyl)methyl-propylamino]-N-(3-methoxypropyl)acetamide
CID 61486088
2-[benzyl(4-methoxybutyl)amino]acetic acid
CID 119134936
2-[(3,4-dimethoxyphenyl)methyl-ethylamino]-N-(2-phenylethyl)acetamide
CID 32663206
2-(diethylamino)-N-(2-phenoxyethyl)acetamide;hydrochloride
CID 3060147
(2R)-2-(dimethylamino)-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methyl-3-phenylpropanamide
CID 95156104

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide?
The IUPAC name of 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide (CID 78787360) is 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide.
What is the SMILES notation for 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide?
The canonical SMILES for 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide is CCN(CC(=O)NCCCOC)Cc1ccccc1.
What is the InChIKey of 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide?
The InChIKey is ORUPWUSGSWFLAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-17(12-14-8-5-4-6-9-14)13-15(18)16-10-7-11-19-2/h4-6,8-9H,3,7,10-13H2,1-2H3,(H,16,18).
What are the key properties of 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide?
2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.66, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide is sourced from PubChem (CID 78787360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).