2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide

C24H30N2O4 — CID 108560077

IUPAC2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide
SMILESCC(Oc1ccc(O)cc1)C(=O)NC1CCN(C(=O)c2ccc(C(C)C)cc2)CC1
InChIInChI=1S/C24H30N2O4/c1-16(2)18-4-6-19(7-5-18)24(29)26-14-12-20(13-15-26)25-23(28)17(3)30-22-10-8-21(27)9-11-22/h4-11,16-17,20,27H,12-15H2,1-3H3,(H,25,28)
InChIKeyWCXUGJDSMWTOMM-UHFFFAOYSA-N
MW410.51 g/mol
LogP3.70
Rot. Bonds6

About 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide

2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide (PubChem CID 108560077) has the molecular formula C24H30N2O4 and a molecular weight of 410.51 g/mol. Its IUPAC name is 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound Name2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide
PubChem CID108560077
Molecular FormulaC24H30N2O4
Molecular Weight410.51 g/mol
Exact Mass410.22
IUPAC Name2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide
SMILESCC(Oc1ccc(O)cc1)C(=O)NC1CCN(C(=O)c2ccc(C(C)C)cc2)CC1
InChIInChI=1S/C24H30N2O4/c1-16(2)18-4-6-19(7-5-18)24(29)26-14-12-20(13-15-26)25-23(28)17(3)30-22-10-8-21(27)9-11-22/h4-11,16-17,20,27H,12-15H2,1-3H3,(H,25,28)
InChIKeyWCXUGJDSMWTOMM-UHFFFAOYSA-N
XLogP3.70
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.51
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-chlorobenzoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108551143
2-(4-hydroxyphenoxy)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]propanamide
CID 108551204
N-[1-(3,4-dichlorobenzoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108551131
2-(4-hydroxyphenoxy)-N-[1-(3,4,5-trihydroxybenzoyl)piperidin-4-yl]propanamide
CID 108551157
N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
CID 108553309
N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]acetamide
CID 49348928
N-[1-(2,5-dichlorobenzoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108551181
N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
CID 108553340
N-[1-(6-oxo-1H-pyridazine-3-carbonyl)piperidin-4-yl]-2-(4-propan-2-ylphenoxy)propanamide
CID 108553323
2-(4-hydroxyphenoxy)-N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]propanamide
CID 108560056
N-[1-(3-chloropropanoyl)piperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108560062
N-[1-(3-chlorobenzoyl)piperidin-4-yl]-2-(4-chlorophenoxy)propanamide
CID 108553149

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide?
The IUPAC name of 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide (CID 108560077) is 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide.
What is the SMILES notation for 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide?
The canonical SMILES for 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide is CC(Oc1ccc(O)cc1)C(=O)NC1CCN(C(=O)c2ccc(C(C)C)cc2)CC1.
What is the InChIKey of 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide?
The InChIKey is WCXUGJDSMWTOMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O4/c1-16(2)18-4-6-19(7-5-18)24(29)26-14-12-20(13-15-26)25-23(28)17(3)30-22-10-8-21(27)9-11-22/h4-11,16-17,20,27H,12-15H2,1-3H3,(H,25,28).
What are the key properties of 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide?
2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide has a molecular weight of 410.51 g/mol, XLogP of 3.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenoxy)-N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 108560077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).