2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide

C15H22N2O2 — CID 142637723

IUPAC2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide
SMILESCc1ccc(CC2(O)CCN(CC(N)=O)CC2)cc1
InChIInChI=1S/C15H22N2O2/c1-12-2-4-13(5-3-12)10-15(19)6-8-17(9-7-15)11-14(16)18/h2-5,19H,6-11H2,1H3,(H2,16,18)
InChIKeyWISOAACJIUXMLZ-UHFFFAOYSA-N
MW262.35 g/mol
LogP0.85
Rot. Bonds4

About 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide

2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide (PubChem CID 142637723) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide
PubChem CID142637723
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide
SMILESCc1ccc(CC2(O)CCN(CC(N)=O)CC2)cc1
InChIInChI=1S/C15H22N2O2/c1-12-2-4-13(5-3-12)10-15(19)6-8-17(9-7-15)11-14(16)18/h2-5,19H,6-11H2,1H3,(H2,16,18)
InChIKeyWISOAACJIUXMLZ-UHFFFAOYSA-N
XLogP0.85
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide
CID 174464839
1-benzyl-4-[(4-methylphenyl)methyl]piperidin-4-ol
CID 10592641
1-(3-hydroxypropyl)-4-[(4-methylphenyl)methyl]piperidin-4-ol
CID 162213078
2-[4-(4-methylphenyl)piperazin-1-yl]acetamide
CID 69030139
4-hydroxy-2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]benzoic acid
CID 70045906
4-hydroxybenzoic acid;2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]ethyl carbonochloridate
CID 174370471
1-[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propyl]-4-[(4-methylphenyl)methyl]piperidin-4-ol
CID 10473406
1-[2-hydroxy-3-(4-hydroxyphenyl)propyl]-4-[(4-methylphenyl)methyl]piperidin-4-ol;hydrochloride
CID 70046577
1-[(4-methylphenyl)methyl]cyclopropane-1-carboxamide
CID 123851701
4-[(4-methylphenyl)methyl]piperidin-4-ol;hydrochloride
CID 22628376
2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetamide
CID 8742873
1-cyclopropyl-3-[(4-methylphenyl)methyl]pyrrolidin-3-ol
CID 62977841

Frequently Asked Questions

What is the IUPAC name of 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide (CID 142637723) is 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide is Cc1ccc(CC2(O)CCN(CC(N)=O)CC2)cc1.
What is the InChIKey of 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide?
The InChIKey is WISOAACJIUXMLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12-2-4-13(5-3-12)10-15(19)6-8-17(9-7-15)11-14(16)18/h2-5,19H,6-11H2,1H3,(H2,16,18).
What are the key properties of 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide?
2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide has a molecular weight of 262.35 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 142637723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).