3-(4-methylphenyl)-1-propylpiperidine;hydrochloride

C15H24ClN — CID 45260158

IUPAC3-(4-methylphenyl)-1-propylpiperidine;hydrochloride
SMILESCCCN1CCCC(c2ccc(C)cc2)C1.Cl
InChIInChI=1S/C15H23N.ClH/c1-3-10-16-11-4-5-15(12-16)14-8-6-13(2)7-9-14;/h6-9,15H,3-5,10-12H2,1-2H3;1H
InChIKeyKRWLIMACVFTUBK-UHFFFAOYSA-N
MW253.82 g/mol
LogP4.01
Rot. Bonds3

About 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride

3-(4-methylphenyl)-1-propylpiperidine;hydrochloride (PubChem CID 45260158) has the molecular formula C15H24ClN and a molecular weight of 253.82 g/mol. Its IUPAC name is 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride.

Molecular Properties

Compound Name3-(4-methylphenyl)-1-propylpiperidine;hydrochloride
PubChem CID45260158
Molecular FormulaC15H24ClN
Molecular Weight253.82 g/mol
Exact Mass253.16
IUPAC Name3-(4-methylphenyl)-1-propylpiperidine;hydrochloride
SMILESCCCN1CCCC(c2ccc(C)cc2)C1.Cl
InChIInChI=1S/C15H23N.ClH/c1-3-10-16-11-4-5-15(12-16)14-8-6-13(2)7-9-14;/h6-9,15H,3-5,10-12H2,1-2H3;1H
InChIKeyKRWLIMACVFTUBK-UHFFFAOYSA-N
XLogP4.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.82
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Cyproheptadine
CID 2913
Cyproheptadine Hydrochloride
CID 13770
1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine
CID 1388
Fenpropidin
CID 91694
N,N-Dimethylphenylethylamine
CID 25125
Alverine
CID 3678
4-Benzylpiperidine
CID 31738
Fenpiprane
CID 197785
Piperidine, 1-(2-phenylethyl)-
CID 9513
Diphemanil
CID 6127
Diisopromine
CID 22262
1-Methyl-4-phenylpiperidine-4-carbonitrile
CID 62513

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride?
The IUPAC name of 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride (CID 45260158) is 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride.
What is the SMILES notation for 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride?
The canonical SMILES for 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride is CCCN1CCCC(c2ccc(C)cc2)C1.Cl.
What is the InChIKey of 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride?
The InChIKey is KRWLIMACVFTUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N.ClH/c1-3-10-16-11-4-5-15(12-16)14-8-6-13(2)7-9-14;/h6-9,15H,3-5,10-12H2,1-2H3;1H.
What are the key properties of 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride?
3-(4-methylphenyl)-1-propylpiperidine;hydrochloride has a molecular weight of 253.82 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-1-propylpiperidine;hydrochloride is sourced from PubChem (CID 45260158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).