N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide

C23H30N2O2 — CID 46965117

IUPACN-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide
SMILESCc1ccc(C2(O)CCN(CCNC(=O)Cc3cccc(C)c3)CC2)cc1
InChIInChI=1S/C23H30N2O2/c1-18-6-8-21(9-7-18)23(27)10-13-25(14-11-23)15-12-24-22(26)17-20-5-3-4-19(2)16-20/h3-9,16,27H,10-15,17H2,1-2H3,(H,24,26)
InChIKeyWVDDWIJNSBLUIT-UHFFFAOYSA-N
MW366.51 g/mol
LogP2.95
Rot. Bonds6

About N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide

N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide (PubChem CID 46965117) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide
PubChem CID46965117
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC NameN-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide
SMILESCc1ccc(C2(O)CCN(CCNC(=O)Cc3cccc(C)c3)CC2)cc1
InChIInChI=1S/C23H30N2O2/c1-18-6-8-21(9-7-18)23(27)10-13-25(14-11-23)15-12-24-22(26)17-20-5-3-4-19(2)16-20/h3-9,16,27H,10-15,17H2,1-2H3,(H,24,26)
InChIKeyWVDDWIJNSBLUIT-UHFFFAOYSA-N
XLogP2.95
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide (CID 46965117) is N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide is Cc1ccc(C2(O)CCN(CCNC(=O)Cc3cccc(C)c3)CC2)cc1.
What is the InChIKey of N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide?
The InChIKey is WVDDWIJNSBLUIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-18-6-8-21(9-7-18)23(27)10-13-25(14-11-23)15-12-24-22(26)17-20-5-3-4-19(2)16-20/h3-9,16,27H,10-15,17H2,1-2H3,(H,24,26).
What are the key properties of N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide?
N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide has a molecular weight of 366.51 g/mol, XLogP of 2.95, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]ethyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 46965117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).