N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide

C22H26N2O2 — CID 10089254

IUPACN-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide
SMILESO=C(CCCN1CCC(NC(=O)c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c25-21(18-8-3-1-4-9-18)12-7-15-24-16-13-20(14-17-24)23-22(26)19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2,(H,23,26)
InChIKeyVVSOHUNZJUMVHS-UHFFFAOYSA-N
MW350.46 g/mol
LogP3.54
Rot. Bonds7

About N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide

N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide (PubChem CID 10089254) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide
PubChem CID10089254
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide
SMILESO=C(CCCN1CCC(NC(=O)c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c25-21(18-8-3-1-4-9-18)12-7-15-24-16-13-20(14-17-24)23-22(26)19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2,(H,23,26)
InChIKeyVVSOHUNZJUMVHS-UHFFFAOYSA-N
XLogP3.54
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-((1-(4-(4-Fluorophenyl)-4-oxobutyl)-4-phenyl-4-piperidinyl)methyl)acetamide
CID 13122
AR-M1000390
CID 9841259
N,N'-dibenzoylpiperazine
CID 80185
1-Benzoylpiperazine
CID 762654
N-(1-(Phenylmethyl)-4-piperidinyl)benzamide
CID 40598
N-Benzoylbenzylamine
CID 73878
4-methyl-N-(2-phenylethyl)benzamide
CID 723105
N-Phenacylbenzamide
CID 259631
4-[(S)-[(2S,5R)-2,5-Dimethyl-4-(2-propenyl)-1-piperazinyl]phenylmethyl]-N,N-diethylbenzamide
CID 6604878
N,N-diethyl-4-((3-fluorophenyl)(piperidin-4-ylidene)methyl)benzamide
CID 10570940
N1,N3-Bis(2,2,6,6-tetramethylpiperidin-4-YL)isophthalamide
CID 6451919
ChiRYun
CID 389617

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide?
The IUPAC name of N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide (CID 10089254) is N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide.
What is the SMILES notation for N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide?
The canonical SMILES for N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide is O=C(CCCN1CCC(NC(=O)c2ccccc2)CC1)c1ccccc1.
What is the InChIKey of N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide?
The InChIKey is VVSOHUNZJUMVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c25-21(18-8-3-1-4-9-18)12-7-15-24-16-13-20(14-17-24)23-22(26)19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2,(H,23,26).
What are the key properties of N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide?
N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide has a molecular weight of 350.46 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 10089254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).