2-anilino-N-(1-benzylpiperidin-4-yl)benzamide

C25H27N3O — CID 27673255

IUPAC2-anilino-N-(1-benzylpiperidin-4-yl)benzamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)c1ccccc1Nc1ccccc1
InChIInChI=1S/C25H27N3O/c29-25(23-13-7-8-14-24(23)26-21-11-5-2-6-12-21)27-22-15-17-28(18-16-22)19-20-9-3-1-4-10-20/h1-14,22,26H,15-19H2,(H,27,29)
InChIKeyIWZUSWCLMOZPEM-UHFFFAOYSA-N
MW385.51 g/mol
LogP4.82
Rot. Bonds6

About 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide

2-anilino-N-(1-benzylpiperidin-4-yl)benzamide (PubChem CID 27673255) has the molecular formula C25H27N3O and a molecular weight of 385.51 g/mol. Its IUPAC name is 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2-anilino-N-(1-benzylpiperidin-4-yl)benzamide
PubChem CID27673255
Molecular FormulaC25H27N3O
Molecular Weight385.51 g/mol
Exact Mass385.22
IUPAC Name2-anilino-N-(1-benzylpiperidin-4-yl)benzamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)c1ccccc1Nc1ccccc1
InChIInChI=1S/C25H27N3O/c29-25(23-13-7-8-14-24(23)26-21-11-5-2-6-12-21)27-22-15-17-28(18-16-22)19-20-9-3-1-4-10-20/h1-14,22,26H,15-19H2,(H,27,29)
InChIKeyIWZUSWCLMOZPEM-UHFFFAOYSA-N
XLogP4.82
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.51
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-benzylpiperidin-4-yl)-2-[3-(2-phenylethoxy)anilino]benzamide
CID 155531910
2-(aminomethyl)-N-(1-benzylpiperidin-4-yl)benzamide
CID 110451979
3-N-(1-benzylpiperidin-4-yl)-2-fluoro-1-N-(4-fluorophenyl)benzene-1,3-dicarboxamide
CID 155425453
2-amino-N-(1-benzylpiperidin-4-yl)pyridine-3-carboxamide
CID 110451976
[2-[(1-benzylpiperidin-4-yl)carbamoyl]-6-fluorophenyl]carbamic acid
CID 68709667
N-(1-benzylpiperidin-4-yl)-2,3-dihydro-1,4-benzodioxine-5-carboxamide;hydrochloride
CID 20544688
N-(1-benzylpiperidin-4-yl)-4-bromobenzamide
CID 1103952
N-[(1-benzylpiperidin-4-yl)carbamothioyl]-2-chlorobenzamide
CID 17176573
N-[1-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-yl]-2-methylbenzamide
CID 110009371
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-methylbenzamide
CID 18121058
N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide
CID 46546920
N-(1-benzylpiperidin-4-yl)-3,5-dichloro-2-iodobenzamide
CID 26691477

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide?
The IUPAC name of 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide (CID 27673255) is 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide.
What is the SMILES notation for 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide?
The canonical SMILES for 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide is O=C(NC1CCN(Cc2ccccc2)CC1)c1ccccc1Nc1ccccc1.
What is the InChIKey of 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide?
The InChIKey is IWZUSWCLMOZPEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N3O/c29-25(23-13-7-8-14-24(23)26-21-11-5-2-6-12-21)27-22-15-17-28(18-16-22)19-20-9-3-1-4-10-20/h1-14,22,26H,15-19H2,(H,27,29).
What are the key properties of 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide?
2-anilino-N-(1-benzylpiperidin-4-yl)benzamide has a molecular weight of 385.51 g/mol, XLogP of 4.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(1-benzylpiperidin-4-yl)benzamide is sourced from PubChem (CID 27673255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).