4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide

C20H25N3O — CID 110745886

IUPAC4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
SMILESCN(C)c1ccc(C(=O)NC2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H25N3O/c1-22(2)18-10-8-16(9-11-18)20(24)21-17-12-14-23(15-13-17)19-6-4-3-5-7-19/h3-11,17H,12-15H2,1-2H3,(H,21,24)
InChIKeyTWLSRBGAGPPUKX-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.15
Rot. Bonds4

About 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide

4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide (PubChem CID 110745886) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
PubChem CID110745886
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
SMILESCN(C)c1ccc(C(=O)NC2CCN(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H25N3O/c1-22(2)18-10-8-16(9-11-18)20(24)21-17-12-14-23(15-13-17)19-6-4-3-5-7-19/h3-11,17H,12-15H2,1-2H3,(H,21,24)
InChIKeyTWLSRBGAGPPUKX-UHFFFAOYSA-N
XLogP3.15
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide (CID 110745886) is 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide is CN(C)c1ccc(C(=O)NC2CCN(c3ccccc3)CC2)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide?
The InChIKey is TWLSRBGAGPPUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-22(2)18-10-8-16(9-11-18)20(24)21-17-12-14-23(15-13-17)19-6-4-3-5-7-19/h3-11,17H,12-15H2,1-2H3,(H,21,24).
What are the key properties of 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide?
4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide has a molecular weight of 323.44 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide is sourced from PubChem (CID 110745886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).