N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide

C15H24N2O2 — CID 112722389

IUPACN-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide
SMILESCOCCCNC(=O)CNCCc1ccccc1C
InChIInChI=1S/C15H24N2O2/c1-13-6-3-4-7-14(13)8-10-16-12-15(18)17-9-5-11-19-2/h3-4,6-7,16H,5,8-12H2,1-2H3,(H,17,18)
InChIKeyFLSDKOYAIJCZHY-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.28
Rot. Bonds9

About N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide

N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide (PubChem CID 112722389) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide
PubChem CID112722389
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide
SMILESCOCCCNC(=O)CNCCc1ccccc1C
InChIInChI=1S/C15H24N2O2/c1-13-6-3-4-7-14(13)8-10-16-12-15(18)17-9-5-11-19-2/h3-4,6-7,16H,5,8-12H2,1-2H3,(H,17,18)
InChIKeyFLSDKOYAIJCZHY-UHFFFAOYSA-N
XLogP1.28
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.28
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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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide?
The IUPAC name of N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide (CID 112722389) is N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide?
The canonical SMILES for N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide is COCCCNC(=O)CNCCc1ccccc1C.
What is the InChIKey of N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide?
The InChIKey is FLSDKOYAIJCZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-13-6-3-4-7-14(13)8-10-16-12-15(18)17-9-5-11-19-2/h3-4,6-7,16H,5,8-12H2,1-2H3,(H,17,18).
What are the key properties of N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide?
N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.28, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-[2-(2-methylphenyl)ethylamino]acetamide is sourced from PubChem (CID 112722389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).