N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide

C22H28N2O2 — CID 12741880

IUPACN-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
SMILESCCC(=O)N(c1ccccc1O)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C22H28N2O2/c1-2-22(26)24(20-10-6-7-11-21(20)25)19-13-16-23(17-14-19)15-12-18-8-4-3-5-9-18/h3-11,19,25H,2,12-17H2,1H3
InChIKeyXZOQDVTVOPRUKT-UHFFFAOYSA-N
MW352.48 g/mol
LogP3.84
Rot. Bonds6

About N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide

N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide (PubChem CID 12741880) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
PubChem CID12741880
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC NameN-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
SMILESCCC(=O)N(c1ccccc1O)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C22H28N2O2/c1-2-22(26)24(20-10-6-7-11-21(20)25)19-13-16-23(17-14-19)15-12-18-8-4-3-5-9-18/h3-11,19,25H,2,12-17H2,1H3
InChIKeyXZOQDVTVOPRUKT-UHFFFAOYSA-N
XLogP3.84
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The IUPAC name of N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide (CID 12741880) is N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide is CCC(=O)N(c1ccccc1O)C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The InChIKey is XZOQDVTVOPRUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c1-2-22(26)24(20-10-6-7-11-21(20)25)19-13-16-23(17-14-19)15-12-18-8-4-3-5-9-18/h3-11,19,25H,2,12-17H2,1H3.
What are the key properties of N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide has a molecular weight of 352.48 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 12741880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).