4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride

C14H28ClN — CID 3047643

IUPAC4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride
SMILESCC(C)N1CCC(C2CCCCC2)CC1.Cl
InChIInChI=1S/C14H27N.ClH/c1-12(2)15-10-8-14(9-11-15)13-6-4-3-5-7-13;/h12-14H,3-11H2,1-2H3;1H
InChIKeyNRVYNZHIMCNVEP-UHFFFAOYSA-N
MW245.84 g/mol
LogP4.11
Rot. Bonds2

About 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride

4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride (PubChem CID 3047643) has the molecular formula C14H28ClN and a molecular weight of 245.84 g/mol. Its IUPAC name is 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride.

Molecular Properties

Compound Name4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride
PubChem CID3047643
Molecular FormulaC14H28ClN
Molecular Weight245.84 g/mol
Exact Mass245.19
IUPAC Name4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride
SMILESCC(C)N1CCC(C2CCCCC2)CC1.Cl
InChIInChI=1S/C14H27N.ClH/c1-12(2)15-10-8-14(9-11-15)13-6-4-3-5-7-13;/h12-14H,3-11H2,1-2H3;1H
InChIKeyNRVYNZHIMCNVEP-UHFFFAOYSA-N
XLogP4.11
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.84
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Cyclohexylmethyl-4-methyl-piperidine
CID 15153359
3-(4-Methylcyclohexyl)-1-propylpiperidine;hydrochloride
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3-(3-Methylcyclohexyl)-1-propylpiperidine;hydrochloride
CID 45260056
3-Cyclohexyl-1-propylpiperidine;hydrochloride
CID 45260069
3-(2-Methylcyclohexyl)-1-propylpiperidine;hydrochloride
CID 45264261
Piperidine, 1-(1-ethylcyclohexyl)-
CID 202078
Piperidine, 1-(1-butylcyclohexyl)-
CID 203370
1-Ethyl-3-(2-methylbutyl)piperidine
CID 3016925
Piperidine, 1-(cyclohexylmethyl)-, hydrochloride
CID 78704
2-(2,2-Dicyclohexylethyl)-1-methylpiperidine
CID 15150412
1,2,4,6-Tetramethylpiperidine
CID 435108
1-(1,5,9-Trimethyl-decyl)-piperidine
CID 44271489

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride?
The IUPAC name of 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride (CID 3047643) is 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride.
What is the SMILES notation for 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride?
The canonical SMILES for 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride is CC(C)N1CCC(C2CCCCC2)CC1.Cl.
What is the InChIKey of 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride?
The InChIKey is NRVYNZHIMCNVEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N.ClH/c1-12(2)15-10-8-14(9-11-15)13-6-4-3-5-7-13;/h12-14H,3-11H2,1-2H3;1H.
What are the key properties of 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride?
4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride has a molecular weight of 245.84 g/mol, XLogP of 4.11, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-1-propan-2-ylpiperidine;hydrochloride is sourced from PubChem (CID 3047643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).