1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone

C13H24N2O — CID 83991628

IUPAC1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone
SMILESCCCC1CC(NC2CC2)CN(C(C)=O)C1
InChIInChI=1S/C13H24N2O/c1-3-4-11-7-13(14-12-5-6-12)9-15(8-11)10(2)16/h11-14H,3-9H2,1-2H3
InChIKeyKJDJLDFMNAHEON-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.78
Rot. Bonds4

About 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone

1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone (PubChem CID 83991628) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone
PubChem CID83991628
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone
SMILESCCCC1CC(NC2CC2)CN(C(C)=O)C1
InChIInChI=1S/C13H24N2O/c1-3-4-11-7-13(14-12-5-6-12)9-15(8-11)10(2)16/h11-14H,3-9H2,1-2H3
InChIKeyKJDJLDFMNAHEON-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-butyl-5-(cyclohexylamino)piperidin-1-yl]ethanone
CID 83999202
1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]butan-1-one
CID 112541312
1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]-3-methylbutan-1-one
CID 112541315
1-[3-(cyclopentylamino)-5-(3-hydroxypropyl)piperidin-1-yl]ethanone
CID 83999907
1-[3-(cyclopropylamino)-5-(2-hydroxybutyl)piperidin-1-yl]ethanone
CID 83991645
1-[3-(cyclopentylamino)-5-propylpiperidin-1-yl]-2-methylpropan-1-one
CID 83999978
1-[4-[(4-propylcyclohexyl)amino]piperidin-1-yl]ethanone
CID 43224264
1-[3-butyl-5-(cyclopropylamino)piperidin-1-yl]propan-1-one
CID 83991653
methyl 3-[1-acetyl-5-(cyclopentylamino)piperidin-3-yl]propanoate
CID 83999906
1-[3-(cyclohexylamino)-5-propylpiperidin-1-yl]-2,2-dimethylpropan-1-one
CID 83999267
1-[3-butyl-5-(cyclopentylmethylamino)piperidin-1-yl]ethanone
CID 83997819
2-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanol
CID 83991999

Frequently Asked Questions

What is the IUPAC name of 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone?
The IUPAC name of 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone (CID 83991628) is 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone.
What is the SMILES notation for 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone?
The canonical SMILES for 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone is CCCC1CC(NC2CC2)CN(C(C)=O)C1.
What is the InChIKey of 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone?
The InChIKey is KJDJLDFMNAHEON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-4-11-7-13(14-12-5-6-12)9-15(8-11)10(2)16/h11-14H,3-9H2,1-2H3.
What are the key properties of 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone?
1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone has a molecular weight of 224.35 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanone is sourced from PubChem (CID 83991628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).