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

C15H22N2O3 — CID 174464839

IUPAC2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide
SMILESCOc1ccc(CC2(O)CCN(CC(N)=O)CC2)cc1
InChIInChI=1S/C15H22N2O3/c1-20-13-4-2-12(3-5-13)10-15(19)6-8-17(9-7-15)11-14(16)18/h2-5,19H,6-11H2,1H3,(H2,16,18)
InChIKeyVODZCZQNJIXOTO-UHFFFAOYSA-N
MW278.35 g/mol
LogP0.55
Rot. Bonds5

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

2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide (PubChem CID 174464839) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide
PubChem CID174464839
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide
SMILESCOc1ccc(CC2(O)CCN(CC(N)=O)CC2)cc1
InChIInChI=1S/C15H22N2O3/c1-20-13-4-2-12(3-5-13)10-15(19)6-8-17(9-7-15)11-14(16)18/h2-5,19H,6-11H2,1H3,(H2,16,18)
InChIKeyVODZCZQNJIXOTO-UHFFFAOYSA-N
XLogP0.55
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-hydroxy-4-[(4-methylphenyl)methyl]piperidin-1-yl]acetamide
CID 142637723
2-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]acetamide
CID 69033368
1-[(4-methoxyphenyl)methyl]cyclohexane-1-carboxamide
CID 69475295
3-[(4-methoxyphenyl)methyl]azetidin-3-ol
CID 83685225
3-[(4-methoxyphenyl)methyl]oxetan-3-ol
CID 83685421
1-(2-amino-2-oxoethyl)-N-(4-methoxyphenyl)piperidine-4-carboxamide
CID 16909192
1-[(5-hydroxy-2,3-dihydro-1-benzofuran-2-yl)methyl]-4-[(4-methoxyphenyl)methyl]piperidin-4-ol
CID 22628413
2-(4-hydroxy-4-methylpiperidin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 80702513
2-[2-[(4-methoxyphenyl)methyl]pyrrolidin-1-yl]acetamide
CID 47280768
1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride
CID 75361270
2-(1-benzyl-4-hydroxypiperidin-4-yl)-1-(4-methoxyphenyl)ethanone;hydrobromide
CID 67119971
2-[(4S)-4-[(2-fluorophenoxy)methyl]-4-hydroxyazepan-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 129454842

Frequently Asked Questions

What is the IUPAC name of 2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide (CID 174464839) is 2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide is COc1ccc(CC2(O)CCN(CC(N)=O)CC2)cc1.
What is the InChIKey of 2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide?
The InChIKey is VODZCZQNJIXOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-20-13-4-2-12(3-5-13)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-methoxyphenyl)methyl]piperidin-1-yl]acetamide?
2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide has a molecular weight of 278.35 g/mol, XLogP of 0.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-hydroxy-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 174464839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).