2-(4-tert-butylphenyl)piperidine

C15H23N — CID 4137790

IUPAC2-(4-tert-butylphenyl)piperidine
SMILESCC(C)(C)c1ccc(C2CCCCN2)cc1
InChIInChI=1S/C15H23N/c1-15(2,3)13-9-7-12(8-10-13)14-6-4-5-11-16-14/h7-10,14,16H,4-6,11H2,1-3H3
InChIKeyBVZADSBIWVFXJB-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.80
Rot. Bonds1

About 2-(4-tert-butylphenyl)piperidine

2-(4-tert-butylphenyl)piperidine (PubChem CID 4137790) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)piperidine.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)piperidine
PubChem CID4137790
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-(4-tert-butylphenyl)piperidine
SMILESCC(C)(C)c1ccc(C2CCCCN2)cc1
InChIInChI=1S/C15H23N/c1-15(2,3)13-9-7-12(8-10-13)14-6-4-5-11-16-14/h7-10,14,16H,4-6,11H2,1-3H3
InChIKeyBVZADSBIWVFXJB-UHFFFAOYSA-N
XLogP3.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-(trifluoromethyl)phenyl]azepane
CID 3972899
(2R)-2-[4-(4-methylphenyl)phenyl]piperidine
CID 165347942
(2S)-2-(4-bromophenyl)piperidine
CID 7022866
4-piperidin-2-ylphenol
CID 19711202
(2S)-2-phenylpiperidine
CID 10997356
5-(4-tert-butylphenyl)-1-methyl-1,4-diazepane
CID 82295508
(2R)-2-(4-chlorophenyl)piperidine;hydrochloride
CID 155903197
2-[4-(4-methylcyclohexyl)phenyl]piperidine
CID 117397291
(2S)-2-(4-propan-2-ylphenyl)piperidine;hydrochloride
CID 171194841
(2R)-2-(4-methylphenyl)pyrrolidine
CID 7047871
(2R)-2-(4-ethynylphenyl)piperidine
CID 130616360
2-[3-(2-fluoropropan-2-yl)phenyl]piperidine
CID 84687033

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)piperidine?
The IUPAC name of 2-(4-tert-butylphenyl)piperidine (CID 4137790) is 2-(4-tert-butylphenyl)piperidine.
What is the SMILES notation for 2-(4-tert-butylphenyl)piperidine?
The canonical SMILES for 2-(4-tert-butylphenyl)piperidine is CC(C)(C)c1ccc(C2CCCCN2)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)piperidine?
The InChIKey is BVZADSBIWVFXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-15(2,3)13-9-7-12(8-10-13)14-6-4-5-11-16-14/h7-10,14,16H,4-6,11H2,1-3H3.
What are the key properties of 2-(4-tert-butylphenyl)piperidine?
2-(4-tert-butylphenyl)piperidine has a molecular weight of 217.36 g/mol, XLogP of 3.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)piperidine is sourced from PubChem (CID 4137790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).