ethane;4-methyl-1-phenylpiperidine

C14H23N — CID 143180672

IUPACethane;4-methyl-1-phenylpiperidine
SMILESCC.CC1CCN(c2ccccc2)CC1
InChIInChI=1S/C12H17N.C2H6/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;1-2/h2-6,11H,7-10H2,1H3;1-2H3
InChIKeyJLVWRKNQCGCTNN-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.95
Rot. Bonds1

About ethane;4-methyl-1-phenylpiperidine

ethane;4-methyl-1-phenylpiperidine (PubChem CID 143180672) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is ethane;4-methyl-1-phenylpiperidine.

Molecular Properties

Compound Nameethane;4-methyl-1-phenylpiperidine
PubChem CID143180672
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Nameethane;4-methyl-1-phenylpiperidine
SMILESCC.CC1CCN(c2ccccc2)CC1
InChIInChI=1S/C12H17N.C2H6/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;1-2/h2-6,11H,7-10H2,1H3;1-2H3
InChIKeyJLVWRKNQCGCTNN-UHFFFAOYSA-N
XLogP3.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

methylcyclohexane;1-phenylpiperidine
CID 174582589
4-methyl-1-(4-pyrrol-1-ylphenyl)piperidine
CID 91674771
1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]sulfonyl-4-phenylpiperazine
CID 1166947
4-tert-butyl-1-phenylpiperidine
CID 612454
2-[4-(4-methylpiperidin-1-yl)phenyl]isoindole-1,3-dione
CID 168518107
1-phenylpiperidin-4-ol;dihydrochloride
CID 174840165
[4-(4-methylpiperidin-1-yl)phenyl]methylidenehydrazine
CID 168530817
1-[(1S,3S)-3-methylcyclopentyl]-4-phenylpiperazine
CID 6937921
4-(4-methylpiperidin-1-yl)benzonitrile
CID 3152080
3-(4-methylpiperidin-1-yl)benzaldehyde
CID 84758563
ethane;methanol;1-phenylpiperidine
CID 177175072
4-isocyano-1-phenylpiperidine
CID 84770167

Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-1-phenylpiperidine?
The IUPAC name of ethane;4-methyl-1-phenylpiperidine (CID 143180672) is ethane;4-methyl-1-phenylpiperidine.
What is the SMILES notation for ethane;4-methyl-1-phenylpiperidine?
The canonical SMILES for ethane;4-methyl-1-phenylpiperidine is CC.CC1CCN(c2ccccc2)CC1.
What is the InChIKey of ethane;4-methyl-1-phenylpiperidine?
The InChIKey is JLVWRKNQCGCTNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N.C2H6/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;1-2/h2-6,11H,7-10H2,1H3;1-2H3.
What are the key properties of ethane;4-methyl-1-phenylpiperidine?
ethane;4-methyl-1-phenylpiperidine has a molecular weight of 205.34 g/mol, XLogP of 3.95, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-1-phenylpiperidine is sourced from PubChem (CID 143180672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).