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

C15H22N2O2 — CID 60684693

IUPAC2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CN1CCCCC1CO)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-16(13-7-3-2-4-8-13)15(19)11-17-10-6-5-9-14(17)12-18/h2-4,7-8,14,18H,5-6,9-12H2,1H3
InChIKeyYZIIBHAYXINYIP-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.50
Rot. Bonds4

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

2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide (PubChem CID 60684693) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide
PubChem CID60684693
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CN1CCCCC1CO)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-16(13-7-3-2-4-8-13)15(19)11-17-10-6-5-9-14(17)12-18/h2-4,7-8,14,18H,5-6,9-12H2,1H3
InChIKeyYZIIBHAYXINYIP-UHFFFAOYSA-N
XLogP1.50
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-methyl-N-phenylacetamide
CID 78942501
2-[2-(aminomethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide;hydrochloride
CID 119916209
2-[2-(3-hydroxypropyl)pyrrolidin-1-yl]-N-methyl-N-phenylacetamide
CID 62467967
1-[2-(N-methylanilino)-2-oxoethyl]piperidine-2-carboxylic acid
CID 43441165
2-[2-(hydroxymethyl)azepan-1-yl]-N,N-dimethylacetamide
CID 116637269
N-benzyl-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-methylacetamide
CID 78942574
2-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]-N-methyl-N-phenylacetamide
CID 102788924
3-methyl-1-[2-(N-methylanilino)-2-oxoethyl]piperidine-2-carboxylic acid
CID 107072416
N-cyclohexyl-2-[2-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide
CID 60684649
N-ethyl-2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenylacetamide
CID 60690329
2-methyl-1-[2-(N-methylanilino)-2-oxoethyl]piperidine-4-carboxylic acid
CID 106745081
N-[(2-bromophenyl)methyl]-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-methylacetamide
CID 62734419

Frequently Asked Questions

What is the IUPAC name of 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide?
The IUPAC name of 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide (CID 60684693) is 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide is CN(C(=O)CN1CCCCC1CO)c1ccccc1.
What is the InChIKey of 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide?
The InChIKey is YZIIBHAYXINYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-16(13-7-3-2-4-8-13)15(19)11-17-10-6-5-9-14(17)12-18/h2-4,7-8,14,18H,5-6,9-12H2,1H3.
What are the key properties of 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide?
2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide has a molecular weight of 262.35 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(hydroxymethyl)piperidin-1-yl]-N-methyl-N-phenylacetamide is sourced from PubChem (CID 60684693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).