2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide

C14H20N2O2 — CID 115873944

IUPAC2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide
SMILESCC1(O)CCCN(CC(=O)Nc2ccccc2)C1
InChIInChI=1S/C14H20N2O2/c1-14(18)8-5-9-16(11-14)10-13(17)15-12-6-3-2-4-7-12/h2-4,6-7,18H,5,8-11H2,1H3,(H,15,17)
InChIKeyWYTNAUPNEKKNDZ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.47
Rot. Bonds3

About 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide

2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide (PubChem CID 115873944) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide
PubChem CID115873944
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide
SMILESCC1(O)CCCN(CC(=O)Nc2ccccc2)C1
InChIInChI=1S/C14H20N2O2/c1-14(18)8-5-9-16(11-14)10-13(17)15-12-6-3-2-4-7-12/h2-4,6-7,18H,5,8-11H2,1H3,(H,15,17)
InChIKeyWYTNAUPNEKKNDZ-UHFFFAOYSA-N
XLogP1.47
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-(4-methylphenyl)acetamide
CID 103728385
2-(3-hydroxy-3-methylpiperidin-1-yl)-N-(2,4,6-trichlorophenyl)acetamide
CID 115873788
2-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-(3-methoxyphenyl)acetamide
CID 103728804
N-[2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetyl]-2-phenylacetamide
CID 103358021
N-(3,4-difluorophenyl)-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide
CID 103728541
2-(3-hydroxy-3-methylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
CID 115874121
1-benzyl-3-methylpiperidin-3-ol
CID 15283107
2-(4-hydroxy-4-methylazepan-1-yl)-N-pyrimidin-2-ylacetamide
CID 107408147
N-(3-cyanophenyl)-3-(3-hydroxy-3-methylpiperidin-1-yl)propanamide
CID 115873695
1-[2-(2-fluoroanilino)-2-oxoethyl]-3-methylpiperidine-3-carboxylic acid
CID 63136985
1-[2-(2-chloroanilino)-2-oxoethyl]-3-methylpiperidine-3-carboxylic acid
CID 63136943
N-(tert-butylcarbamoyl)-2-(3-hydroxy-3-methylpiperidin-1-yl)acetamide
CID 115874162

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide?
The IUPAC name of 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide (CID 115873944) is 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide.
What is the SMILES notation for 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide?
The canonical SMILES for 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide is CC1(O)CCCN(CC(=O)Nc2ccccc2)C1.
What is the InChIKey of 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide?
The InChIKey is WYTNAUPNEKKNDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-14(18)8-5-9-16(11-14)10-13(17)15-12-6-3-2-4-7-12/h2-4,6-7,18H,5,8-11H2,1H3,(H,15,17).
What are the key properties of 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide?
2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide has a molecular weight of 248.33 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-3-methylpiperidin-1-yl)-N-phenylacetamide is sourced from PubChem (CID 115873944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).