2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide

C14H21NO4 — CID 107679972

IUPAC2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide
SMILESCOCCCNC(=O)C(C)Oc1cc(C)cc(O)c1
InChIInChI=1S/C14H21NO4/c1-10-7-12(16)9-13(8-10)19-11(2)14(17)15-5-4-6-18-3/h7-9,11,16H,4-6H2,1-3H3,(H,15,17)
InChIKeyLPFBFNSUXGGHLE-UHFFFAOYSA-N
MW267.32 g/mol
LogP1.62
Rot. Bonds7

About 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide

2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide (PubChem CID 107679972) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide.

Molecular Properties

Compound Name2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide
PubChem CID107679972
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC Name2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide
SMILESCOCCCNC(=O)C(C)Oc1cc(C)cc(O)c1
InChIInChI=1S/C14H21NO4/c1-10-7-12(16)9-13(8-10)19-11(2)14(17)15-5-4-6-18-3/h7-9,11,16H,4-6H2,1-3H3,(H,15,17)
InChIKeyLPFBFNSUXGGHLE-UHFFFAOYSA-N
XLogP1.62
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)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

2-(3-hydroxy-5-methylphenoxy)-N-(2-methoxyethyl)propanamide
CID 107680229
2-(3-hydroxyphenoxy)-N-(3-methoxypropyl)propanamide
CID 43326339
(2S)-2-(3-methoxyphenoxy)-N-(3-methoxypropyl)propanamide
CID 92673516
2-(4-chloro-3-methylphenoxy)-N-(3-methoxypropyl)propanamide
CID 53288853
2-(4-bromophenoxy)-N-(3-methoxypropyl)propanamide
CID 43083158
2-[4-[(1S)-1-aminoethyl]phenoxy]-N-(3-methoxypropyl)propanamide
CID 63367457
2-[3-[(1R)-1-aminoethyl]phenoxy]-N-(3-methoxypropyl)propanamide
CID 78937481
2-[3-[(1S)-1-aminoethyl]phenoxy]-N-(3-methoxypropyl)propanamide
CID 63367423
2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]-N-(3-methoxypropyl)propanamide
CID 63650006
(2S)-2-(3,5-dimethylphenoxy)-N-(2-methylpropyl)propanamide
CID 9181944
N-(3-methoxypropyl)-2-[4-[1-(methylamino)ethyl]phenoxy]propanamide
CID 43279204
N-[2-(3,5-dimethylphenoxy)ethyl]-2-(4-methylphenoxy)propanamide
CID 133240246

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide?
The IUPAC name of 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide (CID 107679972) is 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide.
What is the SMILES notation for 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide?
The canonical SMILES for 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide is COCCCNC(=O)C(C)Oc1cc(C)cc(O)c1.
What is the InChIKey of 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide?
The InChIKey is LPFBFNSUXGGHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-10-7-12(16)9-13(8-10)19-11(2)14(17)15-5-4-6-18-3/h7-9,11,16H,4-6H2,1-3H3,(H,15,17).
What are the key properties of 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide?
2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide has a molecular weight of 267.32 g/mol, XLogP of 1.62, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-5-methylphenoxy)-N-(3-methoxypropyl)propanamide is sourced from PubChem (CID 107679972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).