N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide

C16H22N2O3 — CID 60684561

IUPACN-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC(=O)CN1CCCCC1CO
InChIInChI=1S/C16H22N2O3/c19-12-14-8-4-5-9-18(14)11-16(21)17-15(20)10-13-6-2-1-3-7-13/h1-3,6-7,14,19H,4-5,8-12H2,(H,17,20,21)
InChIKeyPVBMBKAYVPMFLC-UHFFFAOYSA-N
MW290.36 g/mol
LogP0.72
Rot. Bonds5

About N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide

N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide (PubChem CID 60684561) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide
PubChem CID60684561
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC(=O)CN1CCCCC1CO
InChIInChI=1S/C16H22N2O3/c19-12-14-8-4-5-9-18(14)11-16(21)17-15(20)10-13-6-2-1-3-7-13/h1-3,6-7,14,19H,4-5,8-12H2,(H,17,20,21)
InChIKeyPVBMBKAYVPMFLC-UHFFFAOYSA-N
XLogP0.72
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetyl]-2-phenylacetamide
CID 66260986
N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]benzamide
CID 60684983
N-[2-[2-(hydroxymethyl)azepan-1-yl]acetyl]benzamide
CID 116637743
1-[2-(hydroxymethyl)pyrrolidin-1-yl]-3-phenylpropan-2-one
CID 55038005
N-[2-[2-(hydroxymethyl)azepan-1-yl]acetyl]furan-2-carboxamide
CID 116637783
N-carbamoyl-2-[2-(hydroxymethyl)azepan-1-yl]acetamide
CID 116637702
N-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60684580
2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyethyl)acetamide
CID 60685168
N'-[2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetyl]benzohydrazide
CID 66262005
2-[2-(hydroxymethyl)piperidin-1-yl]-N-naphthalen-1-ylacetamide
CID 110880917
[(2R)-1-(2-phenylethyl)piperidin-2-yl]methanol
CID 26457952
N-(2,6-dimethylphenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60684578

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide?
The IUPAC name of N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide (CID 60684561) is N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide is O=C(Cc1ccccc1)NC(=O)CN1CCCCC1CO.
What is the InChIKey of N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide?
The InChIKey is PVBMBKAYVPMFLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c19-12-14-8-4-5-9-18(14)11-16(21)17-15(20)10-13-6-2-1-3-7-13/h1-3,6-7,14,19H,4-5,8-12H2,(H,17,20,21).
What are the key properties of N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide?
N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide has a molecular weight of 290.36 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(hydroxymethyl)piperidin-1-yl]acetyl]-2-phenylacetamide is sourced from PubChem (CID 60684561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).