N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide

C15H23NO4 — CID 103770844

IUPACN-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)NCC(O)CC(C)C
InChIInChI=1S/C15H23NO4/c1-11(2)8-12(17)9-16-15(18)10-20-14-7-5-4-6-13(14)19-3/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18)
InChIKeyYPWIWBDONMNEON-UHFFFAOYSA-N
MW281.35 g/mol
LogP1.60
Rot. Bonds8

About N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide

N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide (PubChem CID 103770844) has the molecular formula C15H23NO4 and a molecular weight of 281.35 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide
PubChem CID103770844
Molecular FormulaC15H23NO4
Molecular Weight281.35 g/mol
Exact Mass281.16
IUPAC NameN-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)NCC(O)CC(C)C
InChIInChI=1S/C15H23NO4/c1-11(2)8-12(17)9-16-15(18)10-20-14-7-5-4-6-13(14)19-3/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18)
InChIKeyYPWIWBDONMNEON-UHFFFAOYSA-N
XLogP1.60
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.35
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-4-methylpentyl)-2-(2-hydroxyphenoxy)acetamide
CID 103822650
2-[2-[(2-hydroxy-4-methylpentyl)amino]-2-oxoethoxy]benzamide
CID 107155288
N-(2-hydroxy-4-methylpentyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 103771540
2-(2-aminophenoxy)-N-(2-hydroxy-4-methylpentyl)acetamide
CID 107150626
N-(2-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide
CID 115700511
N-(2-hydroxy-3-methylbutyl)-2-(2-methoxyphenoxy)acetamide
CID 115701647
2-[[2-(2-methoxyphenoxy)acetyl]amino]-N-(2-methylpropyl)acetamide
CID 49167933
N-(2-aminopropyl)-2-(2-methoxyphenoxy)acetamide
CID 82354186
2-(2-methoxyphenoxy)-N-(3-methyl-2-propan-2-ylbutyl)acetamide
CID 102914369
N-(2-hydroxy-4-methylpentyl)-2-(2-nitrophenoxy)acetamide
CID 103771047
N-(2-hydroxy-4-methylpentyl)-2-(4-methoxyphenoxy)acetamide
CID 103771418
N-(3-amino-2-methylpropyl)-2-(2-methoxyphenoxy)acetamide
CID 115267431

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide (CID 103770844) is N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)NCC(O)CC(C)C.
What is the InChIKey of N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide?
The InChIKey is YPWIWBDONMNEON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO4/c1-11(2)8-12(17)9-16-15(18)10-20-14-7-5-4-6-13(14)19-3/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18).
What are the key properties of N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide?
N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide has a molecular weight of 281.35 g/mol, XLogP of 1.60, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylpentyl)-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 103770844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).