1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one

C15H25NO2 — CID 155710662

IUPAC1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one
SMILESCC(C)C(=O)CC1CCN(C(=O)C2CCC2)CC1
InChIInChI=1S/C15H25NO2/c1-11(2)14(17)10-12-6-8-16(9-7-12)15(18)13-4-3-5-13/h11-13H,3-10H2,1-2H3
InChIKeyHMXPIJCULVWKQA-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.64
Rot. Bonds4

About 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one

1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one (PubChem CID 155710662) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one.

Molecular Properties

Compound Name1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one
PubChem CID155710662
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one
SMILESCC(C)C(=O)CC1CCN(C(=O)C2CCC2)CC1
InChIInChI=1S/C15H25NO2/c1-11(2)14(17)10-12-6-8-16(9-7-12)15(18)13-4-3-5-13/h11-13H,3-10H2,1-2H3
InChIKeyHMXPIJCULVWKQA-UHFFFAOYSA-N
XLogP2.64
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(cycloheptanecarbonyl)piperidin-4-yl]acetic acid
CID 79614731
1-(azepan-1-yl)-2-[1-(cyclohexanecarbonyl)piperidin-4-yl]ethanone
CID 46295186
3-methyl-1-(1-methyliodanuidylpiperidin-4-yl)butan-2-one
CID 172604494
[4-(aminomethyl)piperidin-1-yl]-cyclobutylmethanone;hydrochloride
CID 53256357
cyclopropyl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 121200495
1-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentylethanone
CID 39997538
3-methyl-1-[1-(2-methylpropyl)piperidin-4-yl]butan-2-one
CID 153390625
(4-aminopiperidin-1-yl)-cyclobutylmethanone
CID 16777962
cycloheptyl-(4-propan-2-ylpiperidin-1-yl)methanone
CID 155764605
cyclobutyl-(4-propan-2-yloxypiperidin-1-yl)methanone
CID 110725421
cyclopropyl-[4-(ethylaminomethyl)piperidin-1-yl]methanone
CID 80552531
2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-(3-propan-2-yloxypropyl)acetamide
CID 46295214

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one?
The IUPAC name of 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one (CID 155710662) is 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one.
What is the SMILES notation for 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one?
The canonical SMILES for 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one is CC(C)C(=O)CC1CCN(C(=O)C2CCC2)CC1.
What is the InChIKey of 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one?
The InChIKey is HMXPIJCULVWKQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-11(2)14(17)10-12-6-8-16(9-7-12)15(18)13-4-3-5-13/h11-13H,3-10H2,1-2H3.
What are the key properties of 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one?
1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one has a molecular weight of 251.37 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-methylbutan-2-one is sourced from PubChem (CID 155710662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).