N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide

C14H21NO4 — CID 115703728

IUPACN-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide
SMILESCCC(O)CCNC(=O)COc1ccccc1OC
InChIInChI=1S/C14H21NO4/c1-3-11(16)8-9-15-14(17)10-19-13-7-5-4-6-12(13)18-2/h4-7,11,16H,3,8-10H2,1-2H3,(H,15,17)
InChIKeyXROXPEMBBILEBZ-UHFFFAOYSA-N
MW267.32 g/mol
LogP1.35
Rot. Bonds8

About N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide

N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide (PubChem CID 115703728) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide
PubChem CID115703728
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC NameN-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide
SMILESCCC(O)CCNC(=O)COc1ccccc1OC
InChIInChI=1S/C14H21NO4/c1-3-11(16)8-9-15-14(17)10-19-13-7-5-4-6-12(13)18-2/h4-7,11,16H,3,8-10H2,1-2H3,(H,15,17)
InChIKeyXROXPEMBBILEBZ-UHFFFAOYSA-N
XLogP1.35
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-4-[[2-(2-methoxyphenoxy)acetyl]amino]butanoic acid
CID 107831912
N-(3-aminobutyl)-2-(2-methoxyphenoxy)acetamide;hydrochloride
CID 119494768
N-(2-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide
CID 115700511
N-(2-ethylbutyl)-2-(2-methoxyphenoxy)acetamide
CID 115612569
2-(2-ethoxyphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide
CID 8961000
N-hexyl-2-(2-methoxyphenoxy)acetamide
CID 19169780
2-(2-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide
CID 44669949
N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide
CID 103770844
2-(2,4-dichlorophenoxy)-N-[(3S)-3-hydroxypentyl]acetamide
CID 97096056
N-(2-hydroxy-3-methylbutyl)-2-(2-methoxyphenoxy)acetamide
CID 115701647
N-[2-(3,5-difluorophenyl)ethyl]-2-(2-methoxyphenoxy)acetamide
CID 51101643
1-(2-methoxyphenoxy)pentan-3-ol
CID 112501425

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide (CID 115703728) is N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide is CCC(O)CCNC(=O)COc1ccccc1OC.
What is the InChIKey of N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide?
The InChIKey is XROXPEMBBILEBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-3-11(16)8-9-15-14(17)10-19-13-7-5-4-6-12(13)18-2/h4-7,11,16H,3,8-10H2,1-2H3,(H,15,17).
What are the key properties of N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide?
N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide has a molecular weight of 267.32 g/mol, XLogP of 1.35, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 115703728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).