N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide

C25H33N3O — CID 140931570

IUPACN,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide
SMILESCN(C)C(=O)c1ccc(N2CCC(C3CCN(c4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C25H33N3O/c1-26(2)25(29)22-8-10-24(11-9-22)28-18-14-21(15-19-28)20-12-16-27(17-13-20)23-6-4-3-5-7-23/h3-11,20-21H,12-19H2,1-2H3
InChIKeyYHVAXYXXDXEOCV-UHFFFAOYSA-N
MW391.56 g/mol
LogP4.52
Rot. Bonds4

About N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide

N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide (PubChem CID 140931570) has the molecular formula C25H33N3O and a molecular weight of 391.56 g/mol. Its IUPAC name is N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide
PubChem CID140931570
Molecular FormulaC25H33N3O
Molecular Weight391.56 g/mol
Exact Mass391.26
IUPAC NameN,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide
SMILESCN(C)C(=O)c1ccc(N2CCC(C3CCN(c4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C25H33N3O/c1-26(2)25(29)22-8-10-24(11-9-22)28-18-14-21(15-19-28)20-12-16-27(17-13-20)23-6-4-3-5-7-23/h3-11,20-21H,12-19H2,1-2H3
InChIKeyYHVAXYXXDXEOCV-UHFFFAOYSA-N
XLogP4.52
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.56
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-hydroxypiperidin-1-yl)-N-methyl-N-phenylbenzamide
CID 111331488
N-cyclopropyl-N-(1-phenylpiperidin-4-yl)-4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)benzamide
CID 24859388
4-(4-hydroxypiperidin-1-yl)-N-methyl-N-propan-2-ylbenzamide
CID 111911911
4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-methyl-N-phenylbenzamide
CID 110417503
N,N-dimethyl-4-[(4-morpholin-4-ylbenzoyl)amino]benzamide
CID 70703870
N,N-dimethyl-3-[[4-(4-methylpiperidin-1-yl)phenyl]carbamoylamino]benzamide
CID 48748137
N,N-dimethyl-4-[4-[[(3R)-1-(2-phenylethyl)piperidin-3-yl]methylamino]piperidin-1-yl]benzamide
CID 42451656
4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
CID 110745886
1-phenylpiperidin-4-ol;dihydrochloride
CID 174840165
4-benzoyl-N,N-dimethylbenzamide
CID 12779824
4-[[[ethylamino-[(1-phenylpyrrolidin-3-yl)methylamino]methylidene]amino]methyl]-N,N-dimethylbenzamide
CID 111874449
N-butan-2-yl-4-(4-hydroxypiperidin-1-yl)-N-methylbenzamide
CID 111464498

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide?
The IUPAC name of N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide (CID 140931570) is N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide?
The canonical SMILES for N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide is CN(C)C(=O)c1ccc(N2CCC(C3CCN(c4ccccc4)CC3)CC2)cc1.
What is the InChIKey of N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide?
The InChIKey is YHVAXYXXDXEOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N3O/c1-26(2)25(29)22-8-10-24(11-9-22)28-18-14-21(15-19-28)20-12-16-27(17-13-20)23-6-4-3-5-7-23/h3-11,20-21H,12-19H2,1-2H3.
What are the key properties of N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide?
N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide has a molecular weight of 391.56 g/mol, XLogP of 4.52, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[4-(1-phenylpiperidin-4-yl)piperidin-1-yl]benzamide is sourced from PubChem (CID 140931570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).