2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide

C14H21NO2 — CID 53282928

IUPAC2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide
SMILESCc1ccc(OC(C)C(=O)NCC(C)C)cc1
InChIInChI=1S/C14H21NO2/c1-10(2)9-15-14(16)12(4)17-13-7-5-11(3)6-8-13/h5-8,10,12H,9H2,1-4H3,(H,15,16)
InChIKeyAMFFTQLCYOBAGV-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.53
Rot. Bonds5

About 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide

2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide (PubChem CID 53282928) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide
PubChem CID53282928
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide
SMILESCc1ccc(OC(C)C(=O)NCC(C)C)cc1
InChIInChI=1S/C14H21NO2/c1-10(2)9-15-14(16)12(4)17-13-7-5-11(3)6-8-13/h5-8,10,12H,9H2,1-4H3,(H,15,16)
InChIKeyAMFFTQLCYOBAGV-UHFFFAOYSA-N
XLogP2.53
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethylphenoxy)-N-(2-methylpropyl)propanamide
CID 60675159
2-(4-tert-butylphenoxy)-N-(2-methylpropyl)propanamide
CID 19204146
(2S)-2-(3,5-dimethylphenoxy)-N-(2-methylpropyl)propanamide
CID 9181944
2-(4-formylphenoxy)-N-(2-methylpropyl)propanamide
CID 43086482
2-(4-methylphenoxy)-N-[(4-methylphenyl)methyl]propanamide
CID 4221032
N-(2-amino-2-phenylethyl)-2-(4-methylphenoxy)propanamide
CID 119528615
4-[2-(4-methylphenoxy)propanoylamino]butanamide
CID 56812745
N-(3-aminopropyl)-2-(4-methylphenoxy)propanamide;hydrochloride
CID 119407044
2-[4-(2-amino-2-sulfanylideneethyl)phenoxy]-N-(2-methylpropyl)propanamide
CID 43116981
2-(4-methylphenoxy)-N-[(E)-pent-3-enyl]propanamide
CID 115627833
2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]propanamide
CID 42892656
2-(4-methylphenoxy)-N-[(2-methylphenyl)methyl]propanamide
CID 46807295

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide (CID 53282928) is 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide is Cc1ccc(OC(C)C(=O)NCC(C)C)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide?
The InChIKey is AMFFTQLCYOBAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10(2)9-15-14(16)12(4)17-13-7-5-11(3)6-8-13/h5-8,10,12H,9H2,1-4H3,(H,15,16).
What are the key properties of 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide?
2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide has a molecular weight of 235.33 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 53282928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).