N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide

C32H31N3O2 — CID 11663164

IUPACN-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1-c1ccc2c(c1)Oc1ccccc1N2C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C32H31N3O2/c1-23(36)33-28-12-6-5-11-27(28)25-15-16-30-32(21-25)37-31-14-8-7-13-29(31)35(30)26-17-19-34(20-18-26)22-24-9-3-2-4-10-24/h2-16,21,26H,17-20,22H2,1H3,(H,33,36)
InChIKeyPSGGHYOJZPLNQQ-UHFFFAOYSA-N
MW489.62 g/mol
LogP7.22
Rot. Bonds5

About N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide

N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide (PubChem CID 11663164) has the molecular formula C32H31N3O2 and a molecular weight of 489.62 g/mol. Its IUPAC name is N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide
PubChem CID11663164
Molecular FormulaC32H31N3O2
Molecular Weight489.62 g/mol
Exact Mass489.24
IUPAC NameN-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1-c1ccc2c(c1)Oc1ccccc1N2C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C32H31N3O2/c1-23(36)33-28-12-6-5-11-27(28)25-15-16-30-32(21-25)37-31-14-8-7-13-29(31)35(30)26-17-19-34(20-18-26)22-24-9-3-2-4-10-24/h2-16,21,26H,17-20,22H2,1H3,(H,33,36)
InChIKeyPSGGHYOJZPLNQQ-UHFFFAOYSA-N
XLogP7.22
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500489.62
LogP ≤ 57.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide?
The IUPAC name of N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide (CID 11663164) is N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide.
What is the SMILES notation for N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide?
The canonical SMILES for N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide is CC(=O)Nc1ccccc1-c1ccc2c(c1)Oc1ccccc1N2C1CCN(Cc2ccccc2)CC1.
What is the InChIKey of N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide?
The InChIKey is PSGGHYOJZPLNQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H31N3O2/c1-23(36)33-28-12-6-5-11-27(28)25-15-16-30-32(21-25)37-31-14-8-7-13-29(31)35(30)26-17-19-34(20-18-26)22-24-9-3-2-4-10-24/h2-16,21,26H,17-20,22H2,1H3,(H,33,36).
What are the key properties of N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide?
N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide has a molecular weight of 489.62 g/mol, XLogP of 7.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[10-(1-benzylpiperidin-4-yl)phenoxazin-3-yl]phenyl]acetamide is sourced from PubChem (CID 11663164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).