1-tritylpiperidine

C24H25N — CID 15372344

IUPAC1-tritylpiperidine
SMILESc1ccc(C(c2ccccc2)(c2ccccc2)N2CCCCC2)cc1
InChIInChI=1S/C24H25N/c1-5-13-21(14-6-1)24(22-15-7-2-8-16-22,23-17-9-3-10-18-23)25-19-11-4-12-20-25/h1-3,5-10,13-18H,4,11-12,19-20H2
InChIKeyZDTBBCYZMFEIHU-UHFFFAOYSA-N
MW327.47 g/mol
LogP5.46
Rot. Bonds4

About 1-tritylpiperidine

1-tritylpiperidine (PubChem CID 15372344) has the molecular formula C24H25N and a molecular weight of 327.47 g/mol. Its IUPAC name is 1-tritylpiperidine.

Molecular Properties

Compound Name1-tritylpiperidine
PubChem CID15372344
Molecular FormulaC24H25N
Molecular Weight327.47 g/mol
Exact Mass327.20
IUPAC Name1-tritylpiperidine
SMILESc1ccc(C(c2ccccc2)(c2ccccc2)N2CCCCC2)cc1
InChIInChI=1S/C24H25N/c1-5-13-21(14-6-1)24(22-15-7-2-8-16-22,23-17-9-3-10-18-23)25-19-11-4-12-20-25/h1-3,5-10,13-18H,4,11-12,19-20H2
InChIKeyZDTBBCYZMFEIHU-UHFFFAOYSA-N
XLogP5.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.47
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

Cinnarizine
CID 1547484
Cyclizine
CID 6726
Phencyclidine
CID 6468
Flunarizine
CID 941361
Benzphetamine
CID 5311017
Naftifine
CID 47641
Budipine
CID 68778
Fendiline
CID 3336
Flunarizine Hydrochloride
CID 5282407
Phencyclidine Hydrochloride
CID 9795678
Rolicyclidine
CID 62436
Trifenmorph
CID 14993

Frequently Asked Questions

What is the IUPAC name of 1-tritylpiperidine?
The IUPAC name of 1-tritylpiperidine (CID 15372344) is 1-tritylpiperidine.
What is the SMILES notation for 1-tritylpiperidine?
The canonical SMILES for 1-tritylpiperidine is c1ccc(C(c2ccccc2)(c2ccccc2)N2CCCCC2)cc1.
What is the InChIKey of 1-tritylpiperidine?
The InChIKey is ZDTBBCYZMFEIHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N/c1-5-13-21(14-6-1)24(22-15-7-2-8-16-22,23-17-9-3-10-18-23)25-19-11-4-12-20-25/h1-3,5-10,13-18H,4,11-12,19-20H2.
What are the key properties of 1-tritylpiperidine?
1-tritylpiperidine has a molecular weight of 327.47 g/mol, XLogP of 5.46, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tritylpiperidine is sourced from PubChem (CID 15372344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).