2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide

C26H26N2O2 — CID 39512672

IUPAC2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
SMILESCc1ccccc1C(=O)NC1CCN(C(=O)c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C26H26N2O2/c1-19-7-5-6-10-24(19)25(29)27-23-15-17-28(18-16-23)26(30)22-13-11-21(12-14-22)20-8-3-2-4-9-20/h2-14,23H,15-18H2,1H3,(H,27,29)
InChIKeyVBQWIOPLVBRQNZ-UHFFFAOYSA-N
MW398.51 g/mol
LogP4.70
Rot. Bonds4

About 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide

2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide (PubChem CID 39512672) has the molecular formula C26H26N2O2 and a molecular weight of 398.51 g/mol. Its IUPAC name is 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
PubChem CID39512672
Molecular FormulaC26H26N2O2
Molecular Weight398.51 g/mol
Exact Mass398.20
IUPAC Name2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
SMILESCc1ccccc1C(=O)NC1CCN(C(=O)c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C26H26N2O2/c1-19-7-5-6-10-24(19)25(29)27-23-15-17-28(18-16-23)26(30)22-13-11-21(12-14-22)20-8-3-2-4-9-20/h2-14,23H,15-18H2,1H3,(H,27,29)
InChIKeyVBQWIOPLVBRQNZ-UHFFFAOYSA-N
XLogP4.70
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.51
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 108550779
2-methyl-N-[1-(4-methylsulfanylbenzoyl)piperidin-4-yl]benzamide
CID 39510378
N-(1-benzoylpiperidin-4-yl)-4-phenylbenzamide
CID 108549483
2-methyl-N-[1-(1-methylpyrazole-4-carbonyl)piperidin-4-yl]benzamide
CID 39510641
N-[1-(furan-3-carbonyl)piperidin-4-yl]-2-methylbenzamide
CID 38207852
N-[1-(4-methylbenzoyl)piperidin-4-yl]-2-sulfanylbenzamide
CID 108554659
4-methoxy-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 108548880
2-methyl-N-[1-[4-(2-oxo-1,3-oxazolidin-3-yl)benzoyl]piperidin-4-yl]benzamide
CID 46465302
[4-(methylamino)piperidin-1-yl]-(4-phenylphenyl)methanone;hydrochloride
CID 119563632
5-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]-1,2-oxazole-3-carboxamide
CID 47800468
N-[1-(2-methylbenzoyl)piperidin-4-yl]pyridine-4-carboxamide
CID 110820250
N-[1-(4-methylbenzoyl)piperidin-4-yl]-2-(trifluoromethyl)benzamide
CID 108555134

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide (CID 39512672) is 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide is Cc1ccccc1C(=O)NC1CCN(C(=O)c2ccc(-c3ccccc3)cc2)CC1.
What is the InChIKey of 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide?
The InChIKey is VBQWIOPLVBRQNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O2/c1-19-7-5-6-10-24(19)25(29)27-23-15-17-28(18-16-23)26(30)22-13-11-21(12-14-22)20-8-3-2-4-9-20/h2-14,23H,15-18H2,1H3,(H,27,29).
What are the key properties of 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide?
2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide has a molecular weight of 398.51 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 39512672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).