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

C16H24N2O3 — CID 60685168

IUPAC2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide
SMILESO=C(CN1CCCCC1CO)NCCOc1ccccc1
InChIInChI=1S/C16H24N2O3/c19-13-14-6-4-5-10-18(14)12-16(20)17-9-11-21-15-7-2-1-3-8-15/h1-3,7-8,14,19H,4-6,9-13H2,(H,17,20)
InChIKeyPHUDURMFPPLRIM-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.03
Rot. Bonds7

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

2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide (PubChem CID 60685168) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide.

Molecular Properties

Compound Name2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide
PubChem CID60685168
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide
SMILESO=C(CN1CCCCC1CO)NCCOc1ccccc1
InChIInChI=1S/C16H24N2O3/c19-13-14-6-4-5-10-18(14)12-16(20)17-9-11-21-15-7-2-1-3-8-15/h1-3,7-8,14,19H,4-6,9-13H2,(H,17,20)
InChIKeyPHUDURMFPPLRIM-UHFFFAOYSA-N
XLogP1.03
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]acetamide
CID 110921401
2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-methoxyethyl)acetamide
CID 60684865
2-[2-(aminomethyl)-3-methylpiperidin-1-yl]-N-(2-phenoxyethyl)acetamide
CID 119926119
N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide
CID 60684561
N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]benzamide
CID 60684983
2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-[(4-propoxyphenyl)methyl]acetamide
CID 110921436
1-[2-oxo-2-(2-phenoxyethylamino)ethyl]pyrrolidine-3-carboxylic acid
CID 63030488
[(2S)-1-(11-phenoxyundecyl)pyrrolidin-2-yl]methanol
CID 14517943
N-[2-[2-(hydroxymethyl)azepan-1-yl]acetyl]benzamide
CID 116637743
2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-[(3-propoxyphenyl)methyl]acetamide
CID 72687729
N-(2-phenoxyethyl)cyclopentanecarboxamide
CID 30349598
2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 62014539

Frequently Asked Questions

What is the IUPAC name of 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide?
The IUPAC name of 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide (CID 60685168) is 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide.
What is the SMILES notation for 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide?
The canonical SMILES for 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide is O=C(CN1CCCCC1CO)NCCOc1ccccc1.
What is the InChIKey of 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide?
The InChIKey is PHUDURMFPPLRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c19-13-14-6-4-5-10-18(14)12-16(20)17-9-11-21-15-7-2-1-3-8-15/h1-3,7-8,14,19H,4-6,9-13H2,(H,17,20).
What are the key properties of 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide?
2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.03, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide is sourced from PubChem (CID 60685168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).