5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine

C18H36N2 — CID 83999048

IUPAC5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine
SMILESCCCCC1CC(NC2CCCCC2)CN(CCC)C1
InChIInChI=1S/C18H36N2/c1-3-5-9-16-13-18(15-20(14-16)12-4-2)19-17-10-7-6-8-11-17/h16-19H,3-15H2,1-2H3
InChIKeyDGSSDRASYVIBLV-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.20
Rot. Bonds7

About 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine

5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine (PubChem CID 83999048) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine.

Molecular Properties

Compound Name5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine
PubChem CID83999048
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine
SMILESCCCCC1CC(NC2CCCCC2)CN(CCC)C1
InChIInChI=1S/C18H36N2/c1-3-5-9-16-13-18(15-20(14-16)12-4-2)19-17-10-7-6-8-11-17/h16-19H,3-15H2,1-2H3
InChIKeyDGSSDRASYVIBLV-UHFFFAOYSA-N
XLogP4.20
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[5-(cyclohexylamino)-1-propylpiperidin-3-yl]propanoic acid
CID 83999059
2-[3-butyl-5-(cyclohexylamino)piperidin-1-yl]acetamide
CID 83999592
3-[5-(cyclohexylamino)-1-(2-hydroxyethyl)piperidin-3-yl]propan-1-ol
CID 83999621
2-[5-(cyclohexylamino)-1-(2-hydroxyethyl)piperidin-3-yl]ethanol
CID 83999617
1-[3-butyl-5-(cyclohexylamino)piperidin-1-yl]ethanone
CID 83999202
5-butyl-N-(2,2-difluoroethyl)-1-propylpiperidin-3-amine
CID 83992822
2-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanol
CID 83991999
5-butyl-1-cyclopentyl-N-cyclopropylpiperidin-3-amine
CID 83991758
1-[3-butyl-5-(cyclohexylamino)piperidin-1-yl]butan-1-one
CID 83999243
2-[3-butyl-5-(cyclopropylamino)piperidin-1-yl]acetamide
CID 83991982
1-(2-aminoethyl)-5-butyl-N-methylpiperidin-3-amine
CID 83990113
N-methyl-1,5-dipropylpiperidin-3-amine
CID 83989593

Frequently Asked Questions

What is the IUPAC name of 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine?
The IUPAC name of 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine (CID 83999048) is 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine.
What is the SMILES notation for 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine?
The canonical SMILES for 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine is CCCCC1CC(NC2CCCCC2)CN(CCC)C1.
What is the InChIKey of 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine?
The InChIKey is DGSSDRASYVIBLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-3-5-9-16-13-18(15-20(14-16)12-4-2)19-17-10-7-6-8-11-17/h16-19H,3-15H2,1-2H3.
What are the key properties of 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine?
5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine has a molecular weight of 280.50 g/mol, XLogP of 4.20, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine is sourced from PubChem (CID 83999048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).