N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide

C14H20N2O2 — CID 79602863

IUPACN-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide
SMILESCc1cccc(NC(=O)CC2CCNCC2)c1O
InChIInChI=1S/C14H20N2O2/c1-10-3-2-4-12(14(10)18)16-13(17)9-11-5-7-15-8-6-11/h2-4,11,15,18H,5-9H2,1H3,(H,16,17)
InChIKeyPIUODIFDFCLPQX-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.03
Rot. Bonds3

About N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide

N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide (PubChem CID 79602863) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide
PubChem CID79602863
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide
SMILESCc1cccc(NC(=O)CC2CCNCC2)c1O
InChIInChI=1S/C14H20N2O2/c1-10-3-2-4-12(14(10)18)16-13(17)9-11-5-7-15-8-6-11/h2-4,11,15,18H,5-9H2,1H3,(H,16,17)
InChIKeyPIUODIFDFCLPQX-UHFFFAOYSA-N
XLogP2.03
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(3-bromo-2-hydroxyphenyl)-2-piperidin-4-ylacetamide
CID 81494966
N-(2-fluoro-3-methylphenyl)-2-pyrrolidin-3-ylacetamide
CID 114254707
N-(4-bromo-2-methylphenyl)-2-piperidin-4-ylacetamide
CID 54910115
N-(3-methyl-4-pyridinyl)-2-piperidin-4-ylacetamide
CID 119876314
N-(2-methylphenyl)-3-piperidin-4-ylpropanamide
CID 62210327
2-(azetidin-3-yl)-N-(2-methylphenyl)acetamide
CID 64615932
N-(2-bromo-5-methylphenyl)-2-piperidin-4-ylacetamide
CID 82757301
N-(2-chloro-3-pyridinyl)-2-piperidin-4-ylacetamide
CID 54910721
N-(2-methylphenyl)-2-(piperidin-4-ylmethoxy)acetamide
CID 39062948
N-[4-methyl-3-[(2-piperidin-4-ylacetyl)amino]phenyl]propanamide;hydrochloride
CID 119725801
N-(2-methyl-5-nitrophenyl)-2-piperidin-4-ylacetamide
CID 61029345
N-[2-methyl-3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-2-piperidin-4-ylacetamide;hydrochloride
CID 154912762

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide?
The IUPAC name of N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide (CID 79602863) is N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide?
The canonical SMILES for N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide is Cc1cccc(NC(=O)CC2CCNCC2)c1O.
What is the InChIKey of N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide?
The InChIKey is PIUODIFDFCLPQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-3-2-4-12(14(10)18)16-13(17)9-11-5-7-15-8-6-11/h2-4,11,15,18H,5-9H2,1H3,(H,16,17).
What are the key properties of N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide?
N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide has a molecular weight of 248.33 g/mol, XLogP of 2.03, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-methylphenyl)-2-piperidin-4-ylacetamide is sourced from PubChem (CID 79602863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).