3,4-bis(4-chlorophenyl)piperidine

C17H17Cl2N — CID 79434307

IUPAC3,4-bis(4-chlorophenyl)piperidine
SMILESClc1ccc(C2CCNCC2c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H17Cl2N/c18-14-5-1-12(2-6-14)16-9-10-20-11-17(16)13-3-7-15(19)8-4-13/h1-8,16-17,20H,9-11H2
InChIKeyUGAAEVGWVNRMTC-UHFFFAOYSA-N
MW306.24 g/mol
LogP4.85
Rot. Bonds2

About 3,4-bis(4-chlorophenyl)piperidine

3,4-bis(4-chlorophenyl)piperidine (PubChem CID 79434307) has the molecular formula C17H17Cl2N and a molecular weight of 306.24 g/mol. Its IUPAC name is 3,4-bis(4-chlorophenyl)piperidine.

Molecular Properties

Compound Name3,4-bis(4-chlorophenyl)piperidine
PubChem CID79434307
Molecular FormulaC17H17Cl2N
Molecular Weight306.24 g/mol
Exact Mass305.07
IUPAC Name3,4-bis(4-chlorophenyl)piperidine
SMILESClc1ccc(C2CCNCC2c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H17Cl2N/c18-14-5-1-12(2-6-14)16-9-10-20-11-17(16)13-3-7-15(19)8-4-13/h1-8,16-17,20H,9-11H2
InChIKeyUGAAEVGWVNRMTC-UHFFFAOYSA-N
XLogP4.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.24
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-chloro-3-fluorophenyl)-3-(4-chlorophenyl)piperidine
CID 79433397
3-(4-chlorophenyl)-4-(2,6-difluorophenyl)piperidine
CID 79433603
3-[3-(4-chlorophenyl)piperidin-4-yl]pyridine
CID 79434183
(3R,4R)-3-(4-chlorophenyl)-4-methylpiperidine
CID 70225291
4-(4-bromo-3-methylphenyl)-3-(4-chlorophenyl)piperidine
CID 79433373
4-(3-chloro-2-fluorophenyl)-3-(4-chlorophenyl)piperidine
CID 114489277
3-(4-chlorophenyl)-4-methoxypiperidine
CID 117236496
4-(5-chloro-2-fluorophenyl)-3-(4-fluorophenyl)piperidine
CID 114867305
3-(3-chlorophenyl)-4-(3,4-difluorophenyl)piperidine
CID 79433508
(3S)-3-(4-chlorophenyl)pyrrolidine;hydrochloride
CID 71742220
4-(3-chloro-4-methylphenyl)-3-phenylpiperidine
CID 106819222
(3R,4S)-4-(4-chlorophenyl)pyrrolidin-3-ol
CID 125117368

Frequently Asked Questions

What is the IUPAC name of 3,4-bis(4-chlorophenyl)piperidine?
The IUPAC name of 3,4-bis(4-chlorophenyl)piperidine (CID 79434307) is 3,4-bis(4-chlorophenyl)piperidine.
What is the SMILES notation for 3,4-bis(4-chlorophenyl)piperidine?
The canonical SMILES for 3,4-bis(4-chlorophenyl)piperidine is Clc1ccc(C2CCNCC2c2ccc(Cl)cc2)cc1.
What is the InChIKey of 3,4-bis(4-chlorophenyl)piperidine?
The InChIKey is UGAAEVGWVNRMTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2N/c18-14-5-1-12(2-6-14)16-9-10-20-11-17(16)13-3-7-15(19)8-4-13/h1-8,16-17,20H,9-11H2.
What are the key properties of 3,4-bis(4-chlorophenyl)piperidine?
3,4-bis(4-chlorophenyl)piperidine has a molecular weight of 306.24 g/mol, XLogP of 4.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-bis(4-chlorophenyl)piperidine is sourced from PubChem (CID 79434307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).