2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide

C19H23NO3 — CID 43915467

IUPAC2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
SMILESCc1ccc(OCCNC(=O)C(C)Oc2ccccc2C)cc1
InChIInChI=1S/C19H23NO3/c1-14-8-10-17(11-9-14)22-13-12-20-19(21)16(3)23-18-7-5-4-6-15(18)2/h4-11,16H,12-13H2,1-3H3,(H,20,21)
InChIKeyQXHKHZJFFORSQF-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.27
Rot. Bonds7

About 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide

2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide (PubChem CID 43915467) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide.

Molecular Properties

Compound Name2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
PubChem CID43915467
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
SMILESCc1ccc(OCCNC(=O)C(C)Oc2ccccc2C)cc1
InChIInChI=1S/C19H23NO3/c1-14-8-10-17(11-9-14)22-13-12-20-19(21)16(3)23-18-7-5-4-6-15(18)2/h4-11,16H,12-13H2,1-3H3,(H,20,21)
InChIKeyQXHKHZJFFORSQF-UHFFFAOYSA-N
XLogP3.27
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.27
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

N-[2-(2,5-dimethylphenoxy)ethyl]-2-(2-methylphenoxy)propanamide
CID 133166083
2-(2-methylphenoxy)-N-[2-(4-propylphenoxy)ethyl]propanamide
CID 133239751
(2S)-N-[2-(2-methylphenoxy)ethyl]-2-phenoxypropanamide
CID 94633957
2-(2-methylphenoxy)-N-[2-(4-methylphenyl)sulfanylethyl]propanamide
CID 43916117
2-(2-methylphenoxy)-N-(2-naphthalen-1-yloxyethyl)propanamide
CID 133220515
(2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide
CID 94633905
N-[2-(4-methylphenoxy)ethyl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133265071
N-[2-(3,4-dimethylphenoxy)ethyl]-2-(2-methoxyphenoxy)propanamide
CID 133211011
2-(4-cyanophenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
CID 51157171
(2R)-2-(4-bromophenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
CID 27823617
2-(2-ethylphenoxy)-N-(2-phenoxyethyl)propanamide
CID 133239770
2-(4-chloro-3-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
CID 132652833

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide?
The IUPAC name of 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide (CID 43915467) is 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide.
What is the SMILES notation for 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide?
The canonical SMILES for 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide is Cc1ccc(OCCNC(=O)C(C)Oc2ccccc2C)cc1.
What is the InChIKey of 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide?
The InChIKey is QXHKHZJFFORSQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-14-8-10-17(11-9-14)22-13-12-20-19(21)16(3)23-18-7-5-4-6-15(18)2/h4-11,16H,12-13H2,1-3H3,(H,20,21).
What are the key properties of 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide?
2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide has a molecular weight of 313.40 g/mol, XLogP of 3.27, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide is sourced from PubChem (CID 43915467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).