4-benzyl-1-(4-methylphenyl)piperidine

C19H23N — CID 101028203

IUPAC4-benzyl-1-(4-methylphenyl)piperidine
SMILESCc1ccc(N2CCC(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C19H23N/c1-16-7-9-19(10-8-16)20-13-11-18(12-14-20)15-17-5-3-2-4-6-17/h2-10,18H,11-15H2,1H3
InChIKeyZANNVQZMQYCDKY-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.45
Rot. Bonds3

About 4-benzyl-1-(4-methylphenyl)piperidine

4-benzyl-1-(4-methylphenyl)piperidine (PubChem CID 101028203) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 4-benzyl-1-(4-methylphenyl)piperidine.

Molecular Properties

Compound Name4-benzyl-1-(4-methylphenyl)piperidine
PubChem CID101028203
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name4-benzyl-1-(4-methylphenyl)piperidine
SMILESCc1ccc(N2CCC(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C19H23N/c1-16-7-9-19(10-8-16)20-13-11-18(12-14-20)15-17-5-3-2-4-6-17/h2-10,18H,11-15H2,1H3
InChIKeyZANNVQZMQYCDKY-UHFFFAOYSA-N
XLogP4.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

4-benzyl-1-[4-(bromomethyl)phenyl]piperidine
CID 107079799
4-(4-benzylpiperidin-1-yl)benzoic acid
CID 22730857
1-[4-(4-benzylpiperidin-1-yl)phenyl]ethanone
CID 39402702
4-benzyl-1-[(4-methylphenyl)methyl]piperidine
CID 3498504
4-benzyl-1-(3,4-dimethoxyphenyl)piperidine
CID 110452584
2-amino-1-[4-(4-benzylpiperidin-1-yl)phenyl]ethanone
CID 83971754
2-[4-(4-benzylpiperidin-1-yl)phenoxy]-N,N-dimethylethanamine
CID 110452589
4-benzyl-1-[4-(dimethylsulfamoylamino)phenyl]piperidine
CID 112985417
4-benzyl-1-methylpiperidine;ethane
CID 142009767
N-[4-(4-benzylpiperidin-1-yl)phenyl]butanamide
CID 112985401
1-(cyclopropylmethyl)-4-methylbenzene
CID 3282669
4-butyl-1-(4-methylphenyl)piperidine
CID 54491585

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-1-(4-methylphenyl)piperidine?
The IUPAC name of 4-benzyl-1-(4-methylphenyl)piperidine (CID 101028203) is 4-benzyl-1-(4-methylphenyl)piperidine.
What is the SMILES notation for 4-benzyl-1-(4-methylphenyl)piperidine?
The canonical SMILES for 4-benzyl-1-(4-methylphenyl)piperidine is Cc1ccc(N2CCC(Cc3ccccc3)CC2)cc1.
What is the InChIKey of 4-benzyl-1-(4-methylphenyl)piperidine?
The InChIKey is ZANNVQZMQYCDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-16-7-9-19(10-8-16)20-13-11-18(12-14-20)15-17-5-3-2-4-6-17/h2-10,18H,11-15H2,1H3.
What are the key properties of 4-benzyl-1-(4-methylphenyl)piperidine?
4-benzyl-1-(4-methylphenyl)piperidine has a molecular weight of 265.40 g/mol, XLogP of 4.45, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-1-(4-methylphenyl)piperidine is sourced from PubChem (CID 101028203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).