1-butan-2-yl-2-phenylpiperidine

C15H23N — CID 167239134

IUPAC1-butan-2-yl-2-phenylpiperidine
SMILESCCC(C)N1CCCCC1c1ccccc1
InChIInChI=1S/C15H23N/c1-3-13(2)16-12-8-7-11-15(16)14-9-5-4-6-10-14/h4-6,9-10,13,15H,3,7-8,11-12H2,1-2H3
InChIKeyCGAMMFRISAORTE-UHFFFAOYSA-N
MW217.36 g/mol
LogP4.01
Rot. Bonds3

About 1-butan-2-yl-2-phenylpiperidine

1-butan-2-yl-2-phenylpiperidine (PubChem CID 167239134) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 1-butan-2-yl-2-phenylpiperidine.

Molecular Properties

Compound Name1-butan-2-yl-2-phenylpiperidine
PubChem CID167239134
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name1-butan-2-yl-2-phenylpiperidine
SMILESCCC(C)N1CCCCC1c1ccccc1
InChIInChI=1S/C15H23N/c1-3-13(2)16-12-8-7-11-15(16)14-9-5-4-6-10-14/h4-6,9-10,13,15H,3,7-8,11-12H2,1-2H3
InChIKeyCGAMMFRISAORTE-UHFFFAOYSA-N
XLogP4.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-phenyl-1-propan-2-ylpiperidine
CID 140931618
1-(3-methylbutan-2-yl)-2-phenylpiperidine
CID 175286836
1-ethyl-2-phenylazepane
CID 59678181
4-[1-(2-phenylpyrrolidin-1-yl)propyl]phenol
CID 82959518
(2S)-2-(4-bromophenyl)-1-[(1R)-1-phenylethyl]piperidine
CID 118395762
1-methyl-2-phenylazepane
CID 23447707
1-butyl-2-phenylpiperidine
CID 10036306
4-[1-(2-phenylpyrrolidin-1-yl)ethyl]aniline
CID 61263705
2-(2-phenylpiperidin-1-yl)acetic acid
CID 23201321
(2R)-2-(4-fluorophenyl)-1-propan-2-ylpiperidine
CID 124501109
N,N-dimethyl-2-phenylpiperidin-1-amine
CID 150714431
ethane;1-ethyl-2-phenylpyrrolidine
CID 177062481

Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-2-phenylpiperidine?
The IUPAC name of 1-butan-2-yl-2-phenylpiperidine (CID 167239134) is 1-butan-2-yl-2-phenylpiperidine.
What is the SMILES notation for 1-butan-2-yl-2-phenylpiperidine?
The canonical SMILES for 1-butan-2-yl-2-phenylpiperidine is CCC(C)N1CCCCC1c1ccccc1.
What is the InChIKey of 1-butan-2-yl-2-phenylpiperidine?
The InChIKey is CGAMMFRISAORTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-3-13(2)16-12-8-7-11-15(16)14-9-5-4-6-10-14/h4-6,9-10,13,15H,3,7-8,11-12H2,1-2H3.
What are the key properties of 1-butan-2-yl-2-phenylpiperidine?
1-butan-2-yl-2-phenylpiperidine has a molecular weight of 217.36 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-2-phenylpiperidine is sourced from PubChem (CID 167239134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).