(2S)-4-ethyl-2-phenylpiperidine

C13H19N — CID 170718389

IUPAC(2S)-4-ethyl-2-phenylpiperidine
SMILESCCC1CCN[C@H](c2ccccc2)C1
InChIInChI=1S/C13H19N/c1-2-11-8-9-14-13(10-11)12-6-4-3-5-7-12/h3-7,11,13-14H,2,8-10H2,1H3/t11?,13-/m0/s1
InChIKeyWJUHJUOPUPFFDG-YUZLPWPTSA-N
MW189.30 g/mol
LogP3.14
Rot. Bonds2

About (2S)-4-ethyl-2-phenylpiperidine

(2S)-4-ethyl-2-phenylpiperidine (PubChem CID 170718389) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is (2S)-4-ethyl-2-phenylpiperidine.

Molecular Properties

Compound Name(2S)-4-ethyl-2-phenylpiperidine
PubChem CID170718389
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name(2S)-4-ethyl-2-phenylpiperidine
SMILESCCC1CCN[C@H](c2ccccc2)C1
InChIInChI=1S/C13H19N/c1-2-11-8-9-14-13(10-11)12-6-4-3-5-7-12/h3-7,11,13-14H,2,8-10H2,1H3/t11?,13-/m0/s1
InChIKeyWJUHJUOPUPFFDG-YUZLPWPTSA-N
XLogP3.14
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(cyclopropylmethyl)-2-phenylpiperidine
CID 174205891
ethyl-[(2-phenylpiperidin-4-yl)methyl]cyanamide
CID 142484586
methyl 4-[(2R,4R)-4-ethylpiperidin-2-yl]benzoate
CID 125468766
5-ethyl-2-phenylpiperidine
CID 164753658
4-ethyl-2-(3-fluoro-5-methylphenyl)piperidine
CID 79705317
4-ethyl-2-(2-propoxyphenyl)piperidine
CID 104662519
4-(2-ethyl-1H-pyrrol-3-yl)-2-phenylpiperidine
CID 70283329
methyl (2S,4R)-2-phenylpiperidine-4-carboxylate
CID 51441743
3-[4-(methoxymethyl)piperidin-2-yl]phenol
CID 105477696
2-ethyl-3-phenylpyrrolidine
CID 62354556
2-phenyl-4-(trifluoromethyl)piperidine
CID 66330695
2-(7-chloro-1-benzofuran-2-yl)-4-ethylpiperidine
CID 114733072

Frequently Asked Questions

What is the IUPAC name of (2S)-4-ethyl-2-phenylpiperidine?
The IUPAC name of (2S)-4-ethyl-2-phenylpiperidine (CID 170718389) is (2S)-4-ethyl-2-phenylpiperidine.
What is the SMILES notation for (2S)-4-ethyl-2-phenylpiperidine?
The canonical SMILES for (2S)-4-ethyl-2-phenylpiperidine is CCC1CCN[C@H](c2ccccc2)C1.
What is the InChIKey of (2S)-4-ethyl-2-phenylpiperidine?
The InChIKey is WJUHJUOPUPFFDG-YUZLPWPTSA-N. The full InChI is InChI=1S/C13H19N/c1-2-11-8-9-14-13(10-11)12-6-4-3-5-7-12/h3-7,11,13-14H,2,8-10H2,1H3/t11?,13-/m0/s1.
What are the key properties of (2S)-4-ethyl-2-phenylpiperidine?
(2S)-4-ethyl-2-phenylpiperidine has a molecular weight of 189.30 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-ethyl-2-phenylpiperidine is sourced from PubChem (CID 170718389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).