N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide

C26H28N2O — CID 20694800

IUPACN-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide
SMILESO=C(NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C26H28N2O/c29-25(23-12-6-2-7-13-23)27-21-26(24-14-8-3-9-15-24)16-18-28(19-17-26)20-22-10-4-1-5-11-22/h1-15H,16-21H2,(H,27,29)
InChIKeyBWZWAPCMWFOYHN-UHFFFAOYSA-N
MW384.52 g/mol
LogP4.65
Rot. Bonds6

About N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide

N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide (PubChem CID 20694800) has the molecular formula C26H28N2O and a molecular weight of 384.52 g/mol. Its IUPAC name is N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide.

Molecular Properties

Compound NameN-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide
PubChem CID20694800
Molecular FormulaC26H28N2O
Molecular Weight384.52 g/mol
Exact Mass384.22
IUPAC NameN-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide
SMILESO=C(NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C26H28N2O/c29-25(23-12-6-2-7-13-23)27-21-26(24-14-8-3-9-15-24)16-18-28(19-17-26)20-22-10-4-1-5-11-22/h1-15H,16-21H2,(H,27,29)
InChIKeyBWZWAPCMWFOYHN-UHFFFAOYSA-N
XLogP4.65
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.52
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]carbamate
CID 59332945
N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]formamide
CID 23538
N-[(4-methylidene-1-phenylcyclohexyl)methyl]benzamide
CID 20596215
(3R,4R)-N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]-4-hydroxy-1-methylpiperidine-3-carboxamide
CID 157015996
4-(aminomethyl)-N-[(1-phenylcyclopropyl)methyl]benzamide
CID 82546336
3-chloro-N-[(1-phenylcyclopropyl)methyl]benzamide
CID 18153649
N-[[1-benzyl-4-(3-methoxyphenyl)piperidin-4-yl]methyl]-6-methoxycyclohexa-1,5-diene-1-carboxamide
CID 142821284
4-N-[(4-phenylpiperidin-4-yl)methyl]benzene-1,4-dicarboxamide
CID 20978143
4-fluoro-N-[(1-phenylcyclopentyl)methyl]benzamide
CID 737856
N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]benzamide
CID 2095623
4-amino-N-[(1-phenylcyclobutyl)methyl]benzamide
CID 110462616
N-[2-oxo-2-[(1-phenylcyclobutyl)methylamino]ethyl]benzamide
CID 46691539

Frequently Asked Questions

What is the IUPAC name of N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide?
The IUPAC name of N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide (CID 20694800) is N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide.
What is the SMILES notation for N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide?
The canonical SMILES for N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide is O=C(NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1)c1ccccc1.
What is the InChIKey of N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide?
The InChIKey is BWZWAPCMWFOYHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N2O/c29-25(23-12-6-2-7-13-23)27-21-26(24-14-8-3-9-15-24)16-18-28(19-17-26)20-22-10-4-1-5-11-22/h1-15H,16-21H2,(H,27,29).
What are the key properties of N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide?
N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide has a molecular weight of 384.52 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-benzyl-4-phenylpiperidin-4-yl)methyl]benzamide is sourced from PubChem (CID 20694800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).