3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride

C15H30ClN — CID 45260056

IUPAC3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride
SMILESCCCN1CCCC(C2CCCC(C)C2)C1.Cl
InChIInChI=1S/C15H29N.ClH/c1-3-9-16-10-5-8-15(12-16)14-7-4-6-13(2)11-14;/h13-15H,3-12H2,1-2H3;1H
InChIKeyQBGKRLIXQFIXKV-UHFFFAOYSA-N
MW259.86 g/mol
LogP4.36
Rot. Bonds3

About 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride

3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride (PubChem CID 45260056) has the molecular formula C15H30ClN and a molecular weight of 259.86 g/mol. Its IUPAC name is 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride.

Molecular Properties

Compound Name3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride
PubChem CID45260056
Molecular FormulaC15H30ClN
Molecular Weight259.86 g/mol
Exact Mass259.21
IUPAC Name3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride
SMILESCCCN1CCCC(C2CCCC(C)C2)C1.Cl
InChIInChI=1S/C15H29N.ClH/c1-3-9-16-10-5-8-15(12-16)14-7-4-6-13(2)11-14;/h13-15H,3-12H2,1-2H3;1H
InChIKeyQBGKRLIXQFIXKV-UHFFFAOYSA-N
XLogP4.36
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.86
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride?
The IUPAC name of 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride (CID 45260056) is 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride.
What is the SMILES notation for 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride?
The canonical SMILES for 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride is CCCN1CCCC(C2CCCC(C)C2)C1.Cl.
What is the InChIKey of 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride?
The InChIKey is QBGKRLIXQFIXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N.ClH/c1-3-9-16-10-5-8-15(12-16)14-7-4-6-13(2)11-14;/h13-15H,3-12H2,1-2H3;1H.
What are the key properties of 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride?
3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride has a molecular weight of 259.86 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylcyclohexyl)-1-propylpiperidine;hydrochloride is sourced from PubChem (CID 45260056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).