N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide

C16H25NO2 — CID 115612578

IUPACN-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide
SMILESCCC(CC)CNC(=O)CCOc1ccccc1C
InChIInChI=1S/C16H25NO2/c1-4-14(5-2)12-17-16(18)10-11-19-15-9-7-6-8-13(15)3/h6-9,14H,4-5,10-12H2,1-3H3,(H,17,18)
InChIKeyWLDAHCVLESDFGX-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.32
Rot. Bonds8

About N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide

N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide (PubChem CID 115612578) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide
PubChem CID115612578
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide
SMILESCCC(CC)CNC(=O)CCOc1ccccc1C
InChIInChI=1S/C16H25NO2/c1-4-14(5-2)12-17-16(18)10-11-19-15-9-7-6-8-13(15)3/h6-9,14H,4-5,10-12H2,1-3H3,(H,17,18)
InChIKeyWLDAHCVLESDFGX-UHFFFAOYSA-N
XLogP3.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-1-hydroxybutan-2-yl]-3-(2-methylphenoxy)propanamide
CID 104981198
N-methyl-3-(2-methylphenoxy)propanamide
CID 60637088
N-(2-ethylbutyl)-3-(4-methylphenoxy)propanamide
CID 115612574
N-ethoxy-3-(2-methylphenoxy)propanamide
CID 60717709
N-(2-hydroxy-2-thiophen-3-ylethyl)-3-(2-methylphenoxy)propanamide
CID 103771719
4-[3-(2-methylphenoxy)propanoylamino]butanoic acid
CID 43239219
N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-4-(2-methylphenoxy)butanamide
CID 55538099
N-[(2R)-1-hydroxypropan-2-yl]-3-(2-methylphenoxy)propanamide
CID 79027770
N-[(2-chlorophenyl)methyl]-3-(2-methylphenoxy)propanamide
CID 7973168
2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide
CID 115612647
methyl 2-[3-(2-methylphenoxy)propanoylamino]propanoate
CID 60638161
3-[3-(2-methylphenoxy)propanoylamino]butanoic acid
CID 43240704

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide?
The IUPAC name of N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide (CID 115612578) is N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide.
What is the SMILES notation for N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide?
The canonical SMILES for N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide is CCC(CC)CNC(=O)CCOc1ccccc1C.
What is the InChIKey of N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide?
The InChIKey is WLDAHCVLESDFGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-14(5-2)12-17-16(18)10-11-19-15-9-7-6-8-13(15)3/h6-9,14H,4-5,10-12H2,1-3H3,(H,17,18).
What are the key properties of N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide?
N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide has a molecular weight of 263.38 g/mol, XLogP of 3.32, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide is sourced from PubChem (CID 115612578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).