2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide

C15H22N2O3 — CID 60642548

IUPAC2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CN2CCCC(CO)C2)c1
InChIInChI=1S/C15H22N2O3/c1-20-14-6-2-5-13(8-14)16-15(19)10-17-7-3-4-12(9-17)11-18/h2,5-6,8,12,18H,3-4,7,9-11H2,1H3,(H,16,19)
InChIKeyFGZAHARNXOCKRC-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.34
Rot. Bonds5

About 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide

2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide (PubChem CID 60642548) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide
PubChem CID60642548
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CN2CCCC(CO)C2)c1
InChIInChI=1S/C15H22N2O3/c1-20-14-6-2-5-13(8-14)16-15(19)10-17-7-3-4-12(9-17)11-18/h2,5-6,8,12,18H,3-4,7,9-11H2,1H3,(H,16,19)
InChIKeyFGZAHARNXOCKRC-UHFFFAOYSA-N
XLogP1.34
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(aminomethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide;hydrochloride
CID 119915580
2-[4-(cyclohexylmethyl)-1,4-diazepan-1-yl]-N-(3-methoxyphenyl)acetamide
CID 55864033
2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide
CID 8583685
N-(3-ethylphenyl)-2-[3-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60642263
N-(3-methoxyphenyl)-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119921880
2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-(3-methoxyphenyl)acetamide
CID 62046860
N-(3,5-dimethoxyphenyl)-2-[3-(fluoromethyl)piperidin-1-yl]acetamide
CID 171337842
N-(3-methoxyphenyl)-2-[(3R)-3-(2-oxopyrrolidin-1-yl)piperidin-1-yl]acetamide
CID 95560043
N-(3-methylphenyl)-2-[3-(phenoxymethyl)piperidin-1-yl]acetamide
CID 86972186
N-(4-ethoxyphenyl)-2-[3-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60642593
methyl 3-[[2-[3-(phenoxymethyl)piperidin-1-yl]acetyl]amino]benzoate
CID 86972356
2-[3-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyphenyl)acetamide
CID 110877824

Frequently Asked Questions

What is the IUPAC name of 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide (CID 60642548) is 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)CN2CCCC(CO)C2)c1.
What is the InChIKey of 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide?
The InChIKey is FGZAHARNXOCKRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-20-14-6-2-5-13(8-14)16-15(19)10-17-7-3-4-12(9-17)11-18/h2,5-6,8,12,18H,3-4,7,9-11H2,1H3,(H,16,19).
What are the key properties of 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide?
2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide has a molecular weight of 278.35 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 60642548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).