1-[(4-ethenylphenyl)methyl]-4-methylpiperidine

C15H21N — CID 89299852

IUPAC1-[(4-ethenylphenyl)methyl]-4-methylpiperidine
SMILESC=Cc1ccc(CN2CCC(C)CC2)cc1
InChIInChI=1S/C15H21N/c1-3-14-4-6-15(7-5-14)12-16-10-8-13(2)9-11-16/h3-7,13H,1,8-12H2,2H3
InChIKeyMRQYTSISHCATQH-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.56
Rot. Bonds3

About 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine

1-[(4-ethenylphenyl)methyl]-4-methylpiperidine (PubChem CID 89299852) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine.

Molecular Properties

Compound Name1-[(4-ethenylphenyl)methyl]-4-methylpiperidine
PubChem CID89299852
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name1-[(4-ethenylphenyl)methyl]-4-methylpiperidine
SMILESC=Cc1ccc(CN2CCC(C)CC2)cc1
InChIInChI=1S/C15H21N/c1-3-14-4-6-15(7-5-14)12-16-10-8-13(2)9-11-16/h3-7,13H,1,8-12H2,2H3
InChIKeyMRQYTSISHCATQH-UHFFFAOYSA-N
XLogP3.56
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-methyl-1-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]piperidine
CID 53443850
(3R)-1-[(4-ethenylphenyl)methyl]pyrrolidin-3-ol
CID 129494089
N-methyl-4-[(4-methylpiperidin-1-yl)methyl]aniline
CID 83960897
1-[(4-ethenylphenyl)methyl]-4-methyl-1,4-diazepane
CID 166880014
ethane;4-methyl-1-[(4-methylsulfanylphenyl)methyl]piperidine
CID 145130487
1-[(3,4-dichlorophenyl)methyl]-4-methylpiperidine
CID 22197662
4-[(4-methylpiperidin-1-yl)methyl]benzenesulfonic acid
CID 94830309
1-[4-[(4-ethenylphenyl)methyl]piperazin-1-yl]propan-1-one
CID 20722124
[(3S)-1-[(4-ethenylphenyl)methyl]piperidin-3-yl]methanamine
CID 129493697
4-methyl-1-(naphthalen-2-ylmethyl)piperidine
CID 15153361
1-ethenyl-4-[[4-(4-methylcyclohexyl)phenyl]methyl]benzene
CID 20645937
2-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]propanoic acid
CID 105345602

Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine?
The IUPAC name of 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine (CID 89299852) is 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine.
What is the SMILES notation for 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine?
The canonical SMILES for 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine is C=Cc1ccc(CN2CCC(C)CC2)cc1.
What is the InChIKey of 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine?
The InChIKey is MRQYTSISHCATQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-3-14-4-6-15(7-5-14)12-16-10-8-13(2)9-11-16/h3-7,13H,1,8-12H2,2H3.
What are the key properties of 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine?
1-[(4-ethenylphenyl)methyl]-4-methylpiperidine has a molecular weight of 215.34 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-ethenylphenyl)methyl]-4-methylpiperidine is sourced from PubChem (CID 89299852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).