2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide

C16H24N2O4 — CID 56710117

IUPAC2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide
SMILESCOc1ccc(O)cc1CN1CCC(CNC(=O)CO)CC1
InChIInChI=1S/C16H24N2O4/c1-22-15-3-2-14(20)8-13(15)10-18-6-4-12(5-7-18)9-17-16(21)11-19/h2-3,8,12,19-20H,4-7,9-11H2,1H3,(H,17,21)
InChIKeyYHWZXQGNVQOWHR-UHFFFAOYSA-N
MW308.38 g/mol
LogP0.72
Rot. Bonds6

About 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide

2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide (PubChem CID 56710117) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound Name2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide
PubChem CID56710117
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC Name2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide
SMILESCOc1ccc(O)cc1CN1CCC(CNC(=O)CO)CC1
InChIInChI=1S/C16H24N2O4/c1-22-15-3-2-14(20)8-13(15)10-18-6-4-12(5-7-18)9-17-16(21)11-19/h2-3,8,12,19-20H,4-7,9-11H2,1H3,(H,17,21)
InChIKeyYHWZXQGNVQOWHR-UHFFFAOYSA-N
XLogP0.72
TPSA82.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-3-yl]methyl]-3-methylbut-2-enamide
CID 56752294
N-[[(3R)-1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-3-yl]methyl]cyclobutanecarboxamide
CID 95189957
1-[4-methoxy-3-[[4-(methylaminomethyl)piperidin-1-yl]methyl]phenyl]ethanone
CID 63248941
2-hydroxy-N-[[(3R)-1-[(3-hydroxyphenyl)methyl]pyrrolidin-3-yl]methyl]acetamide
CID 95208561
1-[[1-[(5-chloro-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-3-(3-chlorophenyl)urea
CID 1259121
[1-[(5-amino-2-methoxyphenyl)methyl]piperidin-4-yl]methanol
CID 43134614
4-methoxy-3-[[4-(methoxymethyl)piperidin-1-yl]methyl]benzoic acid
CID 63971622
2-hydroxy-N-[[(3R)-1-[(4-methoxy-3-methylphenyl)methyl]piperidin-3-yl]methyl]acetamide
CID 95209152
2-(3,4-dimethoxyphenyl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]acetamide
CID 16896261
N-[[1-[(2-hydroxy-5-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide
CID 103917998
4-methoxy-3-[(4-methylpiperidin-1-yl)methyl]benzoic acid
CID 62019516
1-[4-methoxy-3-[(4-propan-2-ylpiperidin-1-yl)methyl]phenyl]ethanone
CID 103714072

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide?
The IUPAC name of 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide (CID 56710117) is 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide?
The canonical SMILES for 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide is COc1ccc(O)cc1CN1CCC(CNC(=O)CO)CC1.
What is the InChIKey of 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide?
The InChIKey is YHWZXQGNVQOWHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-22-15-3-2-14(20)8-13(15)10-18-6-4-12(5-7-18)9-17-16(21)11-19/h2-3,8,12,19-20H,4-7,9-11H2,1H3,(H,17,21).
What are the key properties of 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide?
2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide has a molecular weight of 308.38 g/mol, XLogP of 0.72, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[[1-[(5-hydroxy-2-methoxyphenyl)methyl]piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 56710117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).