5-propan-2-yl-1-propylpiperidin-2-one

C11H21NO — CID 139951370

IUPAC5-propan-2-yl-1-propylpiperidin-2-one
SMILESCCCN1CC(C(C)C)CCC1=O
InChIInChI=1S/C11H21NO/c1-4-7-12-8-10(9(2)3)5-6-11(12)13/h9-10H,4-8H2,1-3H3
InChIKeyLYCXBRAJDOXQJR-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.29
Rot. Bonds3

About 5-propan-2-yl-1-propylpiperidin-2-one

5-propan-2-yl-1-propylpiperidin-2-one (PubChem CID 139951370) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 5-propan-2-yl-1-propylpiperidin-2-one.

Molecular Properties

Compound Name5-propan-2-yl-1-propylpiperidin-2-one
PubChem CID139951370
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name5-propan-2-yl-1-propylpiperidin-2-one
SMILESCCCN1CC(C(C)C)CCC1=O
InChIInChI=1S/C11H21NO/c1-4-7-12-8-10(9(2)3)5-6-11(12)13/h9-10H,4-8H2,1-3H3
InChIKeyLYCXBRAJDOXQJR-UHFFFAOYSA-N
XLogP2.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-butyl-5-propan-2-ylpiperidin-2-one
CID 139951242
1-pentadecyl-5-propan-2-ylpiperidin-2-one
CID 166871927
1-(2,2-difluoropropyl)-5-propan-2-ylpiperidin-2-one
CID 176821603
5,6-ditert-butyl-1-propylazepan-2-one
CID 59996889
1-butyl-5-(2-methylpropyl)piperidin-2-one
CID 139951244
1-(2,3-dihydroxypropyl)-5-propan-2-ylazepan-2-one
CID 115773415
1-(2-amino-2-cyclopentylethyl)-5-propan-2-ylazepan-2-one
CID 104747788
1-ethyl-4-propan-2-ylpyrrolidin-2-one
CID 122470396
1-[[1-(bromomethyl)cyclopropyl]methyl]-5-propan-2-ylazepan-2-one
CID 65008904
1-[2-(chloromethyl)prop-2-enyl]-5-propan-2-ylazepan-2-one
CID 103065800
4-(1-phenylethyl)-1-propylpyrrolidin-2-one
CID 123830048
5-amino-1-butylpiperidin-2-one
CID 64978058

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-1-propylpiperidin-2-one?
The IUPAC name of 5-propan-2-yl-1-propylpiperidin-2-one (CID 139951370) is 5-propan-2-yl-1-propylpiperidin-2-one.
What is the SMILES notation for 5-propan-2-yl-1-propylpiperidin-2-one?
The canonical SMILES for 5-propan-2-yl-1-propylpiperidin-2-one is CCCN1CC(C(C)C)CCC1=O.
What is the InChIKey of 5-propan-2-yl-1-propylpiperidin-2-one?
The InChIKey is LYCXBRAJDOXQJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-4-7-12-8-10(9(2)3)5-6-11(12)13/h9-10H,4-8H2,1-3H3.
What are the key properties of 5-propan-2-yl-1-propylpiperidin-2-one?
5-propan-2-yl-1-propylpiperidin-2-one has a molecular weight of 183.29 g/mol, XLogP of 2.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-1-propylpiperidin-2-one is sourced from PubChem (CID 139951370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).