2-(3-hydroxyphenoxy)-N-propylpropanamide

C12H17NO3 — CID 43143504

IUPAC2-(3-hydroxyphenoxy)-N-propylpropanamide
SMILESCCCNC(=O)C(C)Oc1cccc(O)c1
InChIInChI=1S/C12H17NO3/c1-3-7-13-12(15)9(2)16-11-6-4-5-10(14)8-11/h4-6,8-9,14H,3,7H2,1-2H3,(H,13,15)
InChIKeyXCLAYZVYOPITJX-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.69
Rot. Bonds5

About 2-(3-hydroxyphenoxy)-N-propylpropanamide

2-(3-hydroxyphenoxy)-N-propylpropanamide (PubChem CID 43143504) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is 2-(3-hydroxyphenoxy)-N-propylpropanamide.

Molecular Properties

Compound Name2-(3-hydroxyphenoxy)-N-propylpropanamide
PubChem CID43143504
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name2-(3-hydroxyphenoxy)-N-propylpropanamide
SMILESCCCNC(=O)C(C)Oc1cccc(O)c1
InChIInChI=1S/C12H17NO3/c1-3-7-13-12(15)9(2)16-11-6-4-5-10(14)8-11/h4-6,8-9,14H,3,7H2,1-2H3,(H,13,15)
InChIKeyXCLAYZVYOPITJX-UHFFFAOYSA-N
XLogP1.69
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3-hydroxyphenoxy)-N-propylpropanamide 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

(2S)-2-(3-methoxyphenoxy)-N-propylpropanamide
CID 30392232
2-(3-hydroxyphenoxy)-N-(3-methoxypropyl)propanamide
CID 43326339
(2S)-2-(3-nitrophenoxy)-N-propylpropanamide
CID 8956680
2-[4-(aminomethyl)phenoxy]-N-propylpropanamide
CID 43115802
(2R)-2-phenoxy-N-[2-[[(2R)-2-phenoxypropanoyl]amino]ethyl]propanamide
CID 7039405
(2R)-2-(3-chlorophenoxy)-N-[2-[[(2R)-2-(3-chlorophenoxy)propanoyl]amino]ethyl]propanamide
CID 2165550
2-(4-fluorophenoxy)-N-propylpropanamide
CID 21366860
butyl 2-(3-hydroxyphenoxy)propanoate
CID 154641842
N-butyl-2-[3-[(1S)-1-hydroxyethyl]phenoxy]propanamide
CID 55190064
N-hexyl-2-(3-methoxyphenoxy)propanamide
CID 19203844
N-[2-(ethylamino)ethyl]-2-(3-methylphenoxy)propanamide
CID 119504615
N-ethyl-2-phenoxypropanamide
CID 4282518

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenoxy)-N-propylpropanamide?
The IUPAC name of 2-(3-hydroxyphenoxy)-N-propylpropanamide (CID 43143504) is 2-(3-hydroxyphenoxy)-N-propylpropanamide.
What is the SMILES notation for 2-(3-hydroxyphenoxy)-N-propylpropanamide?
The canonical SMILES for 2-(3-hydroxyphenoxy)-N-propylpropanamide is CCCNC(=O)C(C)Oc1cccc(O)c1.
What is the InChIKey of 2-(3-hydroxyphenoxy)-N-propylpropanamide?
The InChIKey is XCLAYZVYOPITJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-3-7-13-12(15)9(2)16-11-6-4-5-10(14)8-11/h4-6,8-9,14H,3,7H2,1-2H3,(H,13,15).
What are the key properties of 2-(3-hydroxyphenoxy)-N-propylpropanamide?
2-(3-hydroxyphenoxy)-N-propylpropanamide has a molecular weight of 223.27 g/mol, XLogP of 1.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenoxy)-N-propylpropanamide is sourced from PubChem (CID 43143504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).