5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide

C25H34N2O2 — CID 45484379

IUPAC5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide
SMILESCC(C)Oc1ccccc1-c1ccc(NC(=O)CCCCN2CCCCC2)cc1
InChIInChI=1S/C25H34N2O2/c1-20(2)29-24-11-5-4-10-23(24)21-13-15-22(16-14-21)26-25(28)12-6-9-19-27-17-7-3-8-18-27/h4-5,10-11,13-16,20H,3,6-9,12,17-19H2,1-2H3,(H,26,28)
InChIKeyHWWVGSIRDOQXJD-UHFFFAOYSA-N
MW394.56 g/mol
LogP5.74
Rot. Bonds9

About 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide

5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide (PubChem CID 45484379) has the molecular formula C25H34N2O2 and a molecular weight of 394.56 g/mol. Its IUPAC name is 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide.

Molecular Properties

Compound Name5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide
PubChem CID45484379
Molecular FormulaC25H34N2O2
Molecular Weight394.56 g/mol
Exact Mass394.26
IUPAC Name5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide
SMILESCC(C)Oc1ccccc1-c1ccc(NC(=O)CCCCN2CCCCC2)cc1
InChIInChI=1S/C25H34N2O2/c1-20(2)29-24-11-5-4-10-23(24)21-13-15-22(16-14-21)26-25(28)12-6-9-19-27-17-7-3-8-18-27/h4-5,10-11,13-16,20H,3,6-9,12,17-19H2,1-2H3,(H,26,28)
InChIKeyHWWVGSIRDOQXJD-UHFFFAOYSA-N
XLogP5.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.56
LogP ≤ 55.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide 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 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide?
The IUPAC name of 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide (CID 45484379) is 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide.
What is the SMILES notation for 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide?
The canonical SMILES for 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide is CC(C)Oc1ccccc1-c1ccc(NC(=O)CCCCN2CCCCC2)cc1.
What is the InChIKey of 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide?
The InChIKey is HWWVGSIRDOQXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H34N2O2/c1-20(2)29-24-11-5-4-10-23(24)21-13-15-22(16-14-21)26-25(28)12-6-9-19-27-17-7-3-8-18-27/h4-5,10-11,13-16,20H,3,6-9,12,17-19H2,1-2H3,(H,26,28).
What are the key properties of 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide?
5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide has a molecular weight of 394.56 g/mol, XLogP of 5.74, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-1-yl-N-[4-(2-propan-2-yloxyphenyl)phenyl]pentanamide is sourced from PubChem (CID 45484379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).