2-methyl-2-phenylpiperidine;hydrochloride

C12H18ClN — CID 115027708

IUPAC2-methyl-2-phenylpiperidine;hydrochloride
SMILESCC1(c2ccccc2)CCCCN1.Cl
InChIInChI=1S/C12H17N.ClH/c1-12(9-5-6-10-13-12)11-7-3-2-4-8-11;/h2-4,7-8,13H,5-6,9-10H2,1H3;1H
InChIKeyQPBNQBOQZTYOTO-UHFFFAOYSA-N
MW211.74 g/mol
LogP3.10
Rot. Bonds1

About 2-methyl-2-phenylpiperidine;hydrochloride

2-methyl-2-phenylpiperidine;hydrochloride (PubChem CID 115027708) has the molecular formula C12H18ClN and a molecular weight of 211.74 g/mol. Its IUPAC name is 2-methyl-2-phenylpiperidine;hydrochloride.

Molecular Properties

Compound Name2-methyl-2-phenylpiperidine;hydrochloride
PubChem CID115027708
Molecular FormulaC12H18ClN
Molecular Weight211.74 g/mol
Exact Mass211.11
IUPAC Name2-methyl-2-phenylpiperidine;hydrochloride
SMILESCC1(c2ccccc2)CCCCN1.Cl
InChIInChI=1S/C12H17N.ClH/c1-12(9-5-6-10-13-12)11-7-3-2-4-8-11;/h2-4,7-8,13H,5-6,9-10H2,1H3;1H
InChIKeyQPBNQBOQZTYOTO-UHFFFAOYSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.74
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2-methylazepan-2-yl)phenol
CID 115059442
3-(2-methylpiperidin-2-yl)pyridine
CID 23344429
2-phenylpiperidin-2-ol
CID 173102945
2-(3-methoxyphenyl)-2-methylpiperidine
CID 83532633
4-(2-methylpyrrolidin-2-yl)phenol
CID 82599572
2-(2-methylpiperidin-2-yl)pyridine
CID 83529728
2-methyl-2-thiophen-2-ylpiperidine
CID 83530082
2-methyl-2-[4-(2-methylbutan-2-yl)phenyl]pyrrolidine
CID 117335142
2-(4-ethoxyphenyl)-2-methylpyrrolidine
CID 66467822
2-methyl-2-(2-phenylpyrazol-3-yl)azepane
CID 107330736
2-[3-(2,2-difluoropropyl)phenyl]-2-methylpyrrolidine
CID 117351180
1-hexan-2-yl-3-methyl-3-phenyl-1,4-diazepane
CID 64950353

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-phenylpiperidine;hydrochloride?
The IUPAC name of 2-methyl-2-phenylpiperidine;hydrochloride (CID 115027708) is 2-methyl-2-phenylpiperidine;hydrochloride.
What is the SMILES notation for 2-methyl-2-phenylpiperidine;hydrochloride?
The canonical SMILES for 2-methyl-2-phenylpiperidine;hydrochloride is CC1(c2ccccc2)CCCCN1.Cl.
What is the InChIKey of 2-methyl-2-phenylpiperidine;hydrochloride?
The InChIKey is QPBNQBOQZTYOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N.ClH/c1-12(9-5-6-10-13-12)11-7-3-2-4-8-11;/h2-4,7-8,13H,5-6,9-10H2,1H3;1H.
What are the key properties of 2-methyl-2-phenylpiperidine;hydrochloride?
2-methyl-2-phenylpiperidine;hydrochloride has a molecular weight of 211.74 g/mol, XLogP of 3.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-phenylpiperidine;hydrochloride is sourced from PubChem (CID 115027708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).