4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide

C13H19NO3 — CID 79017762

IUPAC4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide
SMILESCOc1ccc(CCNC(=O)CCCO)cc1
InChIInChI=1S/C13H19NO3/c1-17-12-6-4-11(5-7-12)8-9-14-13(16)3-2-10-15/h4-7,15H,2-3,8-10H2,1H3,(H,14,16)
InChIKeyXGJLZAGFLYETDY-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.13
Rot. Bonds7

About 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide

4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide (PubChem CID 79017762) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide.

Molecular Properties

Compound Name4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide
PubChem CID79017762
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide
SMILESCOc1ccc(CCNC(=O)CCCO)cc1
InChIInChI=1S/C13H19NO3/c1-17-12-6-4-11(5-7-12)8-9-14-13(16)3-2-10-15/h4-7,15H,2-3,8-10H2,1H3,(H,14,16)
InChIKeyXGJLZAGFLYETDY-UHFFFAOYSA-N
XLogP1.13
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 3613637
4-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 110297665
N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyphenyl)pentanamide
CID 110297832
3-acetamido-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 8896928
3-(4-methoxyphenyl)-N-[8-[3-(4-methoxyphenyl)propanoylamino]octyl]propanamide
CID 4661025
4-(4-methoxyphenyl)-N-[2-(methylamino)ethyl]butanamide;hydrochloride
CID 119500056
3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 18107472
N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methoxyphenyl)methylamino]propanamide
CID 109022424
4-[2-[4-(4-methoxyphenoxy)phenyl]ethylamino]-4-oxobutanoic acid
CID 20991677
N-[2-(4-methoxyphenyl)ethyl]-5-methyl-4-oxohexanamide
CID 166676905
4-hydroxy-N-[2-(4-propan-2-ylphenyl)ethyl]butanamide
CID 94689915
5-(4-methoxyphenyl)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide
CID 110297842

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide?
The IUPAC name of 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide (CID 79017762) is 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide.
What is the SMILES notation for 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide?
The canonical SMILES for 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide is COc1ccc(CCNC(=O)CCCO)cc1.
What is the InChIKey of 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide?
The InChIKey is XGJLZAGFLYETDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-17-12-6-4-11(5-7-12)8-9-14-13(16)3-2-10-15/h4-7,15H,2-3,8-10H2,1H3,(H,14,16).
What are the key properties of 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide?
4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide has a molecular weight of 237.30 g/mol, XLogP of 1.13, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[2-(4-methoxyphenyl)ethyl]butanamide is sourced from PubChem (CID 79017762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).