N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide

C25H25N3O3 — CID 11524493

IUPACN-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccccc1-c1ccc2c(c1)Oc1c(O)cccc1N2C1CCNCC1
InChIInChI=1S/C25H25N3O3/c1-16(29)27-20-6-3-2-5-19(20)17-9-10-21-24(15-17)31-25-22(7-4-8-23(25)30)28(21)18-11-13-26-14-12-18/h2-10,15,18,26,30H,11-14H2,1H3,(H,27,29)
InChIKeyADARUHIGSIZRCY-UHFFFAOYSA-N
MW415.49 g/mol
LogP5.01
Rot. Bonds3

About N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide

N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide (PubChem CID 11524493) has the molecular formula C25H25N3O3 and a molecular weight of 415.49 g/mol. Its IUPAC name is N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide
PubChem CID11524493
Molecular FormulaC25H25N3O3
Molecular Weight415.49 g/mol
Exact Mass415.19
IUPAC NameN-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccccc1-c1ccc2c(c1)Oc1c(O)cccc1N2C1CCNCC1
InChIInChI=1S/C25H25N3O3/c1-16(29)27-20-6-3-2-5-19(20)17-9-10-21-24(15-17)31-25-22(7-4-8-23(25)30)28(21)18-11-13-26-14-12-18/h2-10,15,18,26,30H,11-14H2,1H3,(H,27,29)
InChIKeyADARUHIGSIZRCY-UHFFFAOYSA-N
XLogP5.01
TPSA73.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.49
LogP ≤ 55.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide?
The IUPAC name of N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide (CID 11524493) is N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide.
What is the SMILES notation for N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide?
The canonical SMILES for N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide is CC(=O)Nc1ccccc1-c1ccc2c(c1)Oc1c(O)cccc1N2C1CCNCC1.
What is the InChIKey of N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide?
The InChIKey is ADARUHIGSIZRCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O3/c1-16(29)27-20-6-3-2-5-19(20)17-9-10-21-24(15-17)31-25-22(7-4-8-23(25)30)28(21)18-11-13-26-14-12-18/h2-10,15,18,26,30H,11-14H2,1H3,(H,27,29).
What are the key properties of N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide?
N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide has a molecular weight of 415.49 g/mol, XLogP of 5.01, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-hydroxy-10-piperidin-4-ylphenoxazin-3-yl)phenyl]acetamide is sourced from PubChem (CID 11524493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).