N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide

C23H30N2O — CID 10760345

IUPACN,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide
SMILESCCN(CC)C(=O)c1ccc(C(c2ccccc2)C2CCNCC2)cc1
InChIInChI=1S/C23H30N2O/c1-3-25(4-2)23(26)21-12-10-19(11-13-21)22(18-8-6-5-7-9-18)20-14-16-24-17-15-20/h5-13,20,22,24H,3-4,14-17H2,1-2H3
InChIKeyCKNSULFOVOHSDA-UHFFFAOYSA-N
MW350.51 g/mol
LogP4.30
Rot. Bonds6

About N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide

N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide (PubChem CID 10760345) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide.

Molecular Properties

Compound NameN,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide
PubChem CID10760345
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC NameN,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide
SMILESCCN(CC)C(=O)c1ccc(C(c2ccccc2)C2CCNCC2)cc1
InChIInChI=1S/C23H30N2O/c1-3-25(4-2)23(26)21-12-10-19(11-13-21)22(18-8-6-5-7-9-18)20-14-16-24-17-15-20/h5-13,20,22,24H,3-4,14-17H2,1-2H3
InChIKeyCKNSULFOVOHSDA-UHFFFAOYSA-N
XLogP4.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-((1-(4-(4-Fluorophenyl)-4-oxobutyl)-4-phenyl-4-piperidinyl)methyl)acetamide
CID 13122
N-Propylbenzamide
CID 25354
AR-M1000390
CID 9841259
N-Ethylbenzamide
CID 11959
N,N'-dibenzoylpiperazine
CID 80185
N-Butylbenzamide
CID 76024
Benzamide, 4-(1,1-dimethylethyl)-N-(2-(4-morpholinyl)ethyl)-
CID 690446
1-Benzoylpiperazine
CID 762654
N-(1-(Phenylmethyl)-4-piperidinyl)benzamide
CID 40598
N-Benzoylbenzylamine
CID 73878
4-methyl-N-(2-phenylethyl)benzamide
CID 723105
4-(1,1-Dimethylethyl)-N-(phenylmethyl)benzamide
CID 809338

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide?
The IUPAC name of N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide (CID 10760345) is N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide.
What is the SMILES notation for N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide?
The canonical SMILES for N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide is CCN(CC)C(=O)c1ccc(C(c2ccccc2)C2CCNCC2)cc1.
What is the InChIKey of N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide?
The InChIKey is CKNSULFOVOHSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O/c1-3-25(4-2)23(26)21-12-10-19(11-13-21)22(18-8-6-5-7-9-18)20-14-16-24-17-15-20/h5-13,20,22,24H,3-4,14-17H2,1-2H3.
What are the key properties of N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide?
N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide has a molecular weight of 350.51 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[phenyl(piperidin-4-yl)methyl]benzamide is sourced from PubChem (CID 10760345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).