3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide

C21H26N2O — CID 112502353

IUPAC3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide
SMILESCC(CNC(=O)c1cccc(-c2ccccc2)c1)N1CCCCC1
InChIInChI=1S/C21H26N2O/c1-17(23-13-6-3-7-14-23)16-22-21(24)20-12-8-11-19(15-20)18-9-4-2-5-10-18/h2,4-5,8-12,15,17H,3,6-7,13-14,16H2,1H3,(H,22,24)
InChIKeyKDFHDBSSHFOXSY-UHFFFAOYSA-N
MW322.45 g/mol
LogP3.96
Rot. Bonds5

About 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide

3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide (PubChem CID 112502353) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide
PubChem CID112502353
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC Name3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide
SMILESCC(CNC(=O)c1cccc(-c2ccccc2)c1)N1CCCCC1
InChIInChI=1S/C21H26N2O/c1-17(23-13-6-3-7-14-23)16-22-21(24)20-12-8-11-19(15-20)18-9-4-2-5-10-18/h2,4-5,8-12,15,17H,3,6-7,13-14,16H2,1H3,(H,22,24)
InChIKeyKDFHDBSSHFOXSY-UHFFFAOYSA-N
XLogP3.96
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-N-[(2S)-2-pyrrolidin-1-ylpropyl]benzamide
CID 93157618
4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
CID 93157619
3-bromo-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
CID 51710424
3-(1,1-dioxothiazinan-2-yl)-N-(2-piperidin-1-ylpropyl)benzamide
CID 110301682
N-(2-pyrrolidin-1-ylpropyl)-1H-indole-6-carboxamide
CID 78975173
4-methyl-5-phenyl-N-[(2R)-2-piperidin-1-ylpropyl]thiophene-2-carboxamide
CID 125434439
N-[(2S)-2-pyrrolidin-1-ylpropyl]pyridine-3-carboxamide
CID 93157610
4-bromo-3-chloro-N-(2-piperidin-1-ylpropyl)benzamide
CID 80973531
2-bromo-N-(2-piperidin-1-ylpropyl)pyridine-4-carboxamide
CID 103754766
3-amino-4-bromo-N-(2-piperidin-1-ylpropyl)benzamide
CID 61140955
3-methyl-N-(2-phenyl-2-piperidin-1-ylethyl)benzamide
CID 45155327
N-[2-(4-methylpiperidin-1-yl)propyl]benzamide
CID 112502434

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide?
The IUPAC name of 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide (CID 112502353) is 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide.
What is the SMILES notation for 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide?
The canonical SMILES for 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide is CC(CNC(=O)c1cccc(-c2ccccc2)c1)N1CCCCC1.
What is the InChIKey of 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide?
The InChIKey is KDFHDBSSHFOXSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O/c1-17(23-13-6-3-7-14-23)16-22-21(24)20-12-8-11-19(15-20)18-9-4-2-5-10-18/h2,4-5,8-12,15,17H,3,6-7,13-14,16H2,1H3,(H,22,24).
What are the key properties of 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide?
3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide has a molecular weight of 322.45 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide is sourced from PubChem (CID 112502353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).