N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide

C27H28N2O2 — CID 155011720

IUPACN-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide
SMILESO=C(NC(Cc1ccccc1)C(=O)N1CCCCC1c1ccccc1)c1ccccc1
InChIInChI=1S/C27H28N2O2/c30-26(23-16-8-3-9-17-23)28-24(20-21-12-4-1-5-13-21)27(31)29-19-11-10-18-25(29)22-14-6-2-7-15-22/h1-9,12-17,24-25H,10-11,18-20H2,(H,28,30)
InChIKeyHNESWORRBWVWDP-UHFFFAOYSA-N
MW412.53 g/mol
LogP4.78
Rot. Bonds6

About N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide

N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide (PubChem CID 155011720) has the molecular formula C27H28N2O2 and a molecular weight of 412.53 g/mol. Its IUPAC name is N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide
PubChem CID155011720
Molecular FormulaC27H28N2O2
Molecular Weight412.53 g/mol
Exact Mass412.22
IUPAC NameN-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide
SMILESO=C(NC(Cc1ccccc1)C(=O)N1CCCCC1c1ccccc1)c1ccccc1
InChIInChI=1S/C27H28N2O2/c30-26(23-16-8-3-9-17-23)28-24(20-21-12-4-1-5-13-21)27(31)29-19-11-10-18-25(29)22-14-6-2-7-15-22/h1-9,12-17,24-25H,10-11,18-20H2,(H,28,30)
InChIKeyHNESWORRBWVWDP-UHFFFAOYSA-N
XLogP4.78
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.53
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(1-oxo-3-phenyl-1-piperazin-1-ylpropan-2-yl)benzamide
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N-[1-[(3aS,6aR)-3-oxo-3a,5,6,6a-tetrahydrofuro[3,2-b]pyrrol-4-yl]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 142154220
N-[(2S)-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 51730216
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CID 7689318
N-[1-[3-(methylamino)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]benzamide;hydrochloride
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CID 22610283
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N-[1-(azocan-1-yl)-1-oxo-3-phenylpropan-2-yl]pyridine-3-carboxamide
CID 71884193
N-[1-[(1-methylpiperidin-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 71902056
N-[1-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-1-oxo-3-phenylpropan-2-yl]benzamide
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Frequently Asked Questions

What is the IUPAC name of N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide?
The IUPAC name of N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide (CID 155011720) is N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide.
What is the SMILES notation for N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide?
The canonical SMILES for N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide is O=C(NC(Cc1ccccc1)C(=O)N1CCCCC1c1ccccc1)c1ccccc1.
What is the InChIKey of N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide?
The InChIKey is HNESWORRBWVWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28N2O2/c30-26(23-16-8-3-9-17-23)28-24(20-21-12-4-1-5-13-21)27(31)29-19-11-10-18-25(29)22-14-6-2-7-15-22/h1-9,12-17,24-25H,10-11,18-20H2,(H,28,30).
What are the key properties of N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide?
N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide has a molecular weight of 412.53 g/mol, XLogP of 4.78, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-oxo-3-phenyl-1-(2-phenylpiperidin-1-yl)propan-2-yl]benzamide is sourced from PubChem (CID 155011720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).