2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide

C16H24N2O4 — CID 120890491

IUPAC2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide
SMILESCOCC1(CNC(=O)COc2ccc(O)cc2)CCNCC1
InChIInChI=1S/C16H24N2O4/c1-21-12-16(6-8-17-9-7-16)11-18-15(20)10-22-14-4-2-13(19)3-5-14/h2-5,17,19H,6-12H2,1H3,(H,18,20)
InChIKeyFQDGFKZBCBEKJQ-UHFFFAOYSA-N
MW308.38 g/mol
LogP0.90
Rot. Bonds7

About 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide

2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide (PubChem CID 120890491) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide
PubChem CID120890491
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC Name2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide
SMILESCOCC1(CNC(=O)COc2ccc(O)cc2)CCNCC1
InChIInChI=1S/C16H24N2O4/c1-21-12-16(6-8-17-9-7-16)11-18-15(20)10-22-14-4-2-13(19)3-5-14/h2-5,17,19H,6-12H2,1H3,(H,18,20)
InChIKeyFQDGFKZBCBEKJQ-UHFFFAOYSA-N
XLogP0.90
TPSA79.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide (CID 120890491) is 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide is COCC1(CNC(=O)COc2ccc(O)cc2)CCNCC1.
What is the InChIKey of 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide?
The InChIKey is FQDGFKZBCBEKJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-21-12-16(6-8-17-9-7-16)11-18-15(20)10-22-14-4-2-13(19)3-5-14/h2-5,17,19H,6-12H2,1H3,(H,18,20).
What are the key properties of 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide?
2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide has a molecular weight of 308.38 g/mol, XLogP of 0.90, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 120890491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).