(3S)-3-methyl-1-(1-phenylethenyl)piperidine

C14H19N — CID 143536748

IUPAC(3S)-3-methyl-1-(1-phenylethenyl)piperidine
SMILESC=C(c1ccccc1)N1CCC[C@H](C)C1
InChIInChI=1S/C14H19N/c1-12-7-6-10-15(11-12)13(2)14-8-4-3-5-9-14/h3-5,8-9,12H,2,6-7,10-11H2,1H3/t12-/m0/s1
InChIKeyWSCKSLPAKKVCAS-LBPRGKRZSA-N
MW201.31 g/mol
LogP3.39
Rot. Bonds2

About (3S)-3-methyl-1-(1-phenylethenyl)piperidine

(3S)-3-methyl-1-(1-phenylethenyl)piperidine (PubChem CID 143536748) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is (3S)-3-methyl-1-(1-phenylethenyl)piperidine.

Molecular Properties

Compound Name(3S)-3-methyl-1-(1-phenylethenyl)piperidine
PubChem CID143536748
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name(3S)-3-methyl-1-(1-phenylethenyl)piperidine
SMILESC=C(c1ccccc1)N1CCC[C@H](C)C1
InChIInChI=1S/C14H19N/c1-12-7-6-10-15(11-12)13(2)14-8-4-3-5-9-14/h3-5,8-9,12H,2,6-7,10-11H2,1H3/t12-/m0/s1
InChIKeyWSCKSLPAKKVCAS-LBPRGKRZSA-N
XLogP3.39
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;methylidene-(5-methylthiophen-2-yl)borane;3-methyl-1-(1-phenylethenyl)piperidine
CID 143536789
3-(3-methylpiperidin-1-yl)-1-phenylbut-3-en-2-amine
CID 167075215
1-[(3S)-3-methylpiperidin-1-yl]-2-phenylethanone
CID 668860
1-[(3S)-3-methylpiperidin-1-yl]-2,2-diphenylethanone
CID 1292213
(3S)-3-methyl-N-phenylpiperidine-1-carbothioamide
CID 785499
N,3-dimethyl-N-phenylpiperidine-1-carboxamide
CID 108990934
benzyl 3-methylpiperidine-1-carboxylate;ethane
CID 144599174
[3-(3-methylpiperidine-1-carbonyl)phenyl]-piperidin-1-ylmethanone
CID 109052035
[4-(3-methylpiperidine-1-carbonyl)phenyl]-(4-phenylpiperazin-1-yl)methanone
CID 109048199
(3-methylphenyl)-(3-methylpiperidin-1-yl)methanone
CID 3113385
(2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone
CID 43176525
[2-(3-methylpiperidin-1-yl)-2-oxoethyl] 4-benzoylbenzoate
CID 18078989

Frequently Asked Questions

What is the IUPAC name of (3S)-3-methyl-1-(1-phenylethenyl)piperidine?
The IUPAC name of (3S)-3-methyl-1-(1-phenylethenyl)piperidine (CID 143536748) is (3S)-3-methyl-1-(1-phenylethenyl)piperidine.
What is the SMILES notation for (3S)-3-methyl-1-(1-phenylethenyl)piperidine?
The canonical SMILES for (3S)-3-methyl-1-(1-phenylethenyl)piperidine is C=C(c1ccccc1)N1CCC[C@H](C)C1.
What is the InChIKey of (3S)-3-methyl-1-(1-phenylethenyl)piperidine?
The InChIKey is WSCKSLPAKKVCAS-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H19N/c1-12-7-6-10-15(11-12)13(2)14-8-4-3-5-9-14/h3-5,8-9,12H,2,6-7,10-11H2,1H3/t12-/m0/s1.
What are the key properties of (3S)-3-methyl-1-(1-phenylethenyl)piperidine?
(3S)-3-methyl-1-(1-phenylethenyl)piperidine has a molecular weight of 201.31 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methyl-1-(1-phenylethenyl)piperidine is sourced from PubChem (CID 143536748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).