cyclobutyl-[(3R)-piperidin-3-yl]methanone

C10H17NO — CID 124604189

IUPACcyclobutyl-[(3R)-piperidin-3-yl]methanone
SMILESO=C(C1CCC1)[C@@H]1CCCNC1
InChIInChI=1S/C10H17NO/c12-10(8-3-1-4-8)9-5-2-6-11-7-9/h8-9,11H,1-7H2/t9-/m1/s1
InChIKeyVAVVBTHSORKQLF-SECBINFHSA-N
MW167.25 g/mol
LogP1.36
Rot. Bonds2

About cyclobutyl-[(3R)-piperidin-3-yl]methanone

cyclobutyl-[(3R)-piperidin-3-yl]methanone (PubChem CID 124604189) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is cyclobutyl-[(3R)-piperidin-3-yl]methanone.

Molecular Properties

Compound Namecyclobutyl-[(3R)-piperidin-3-yl]methanone
PubChem CID124604189
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Namecyclobutyl-[(3R)-piperidin-3-yl]methanone
SMILESO=C(C1CCC1)[C@@H]1CCCNC1
InChIInChI=1S/C10H17NO/c12-10(8-3-1-4-8)9-5-2-6-11-7-9/h8-9,11H,1-7H2/t9-/m1/s1
InChIKeyVAVVBTHSORKQLF-SECBINFHSA-N
XLogP1.36
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

di(piperidin-3-yl)methanone
CID 69183047
[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone
CID 124675211
di(cyclobutyl)methanone
CID 15444458
(1-methylpyrrolidin-3-yl)-piperidin-3-ylmethanone
CID 116916955
methyl (3S)-piperidine-3-carboxylate;hydrochloride
CID 57345867
ethene;piperidine-3-carboxamide
CID 91354072
(3S)-N-cyclobutylpiperidine-3-carboxamide
CID 81141296
(3S)-N,N-dimethylpiperidine-3-carboxamide
CID 11469201
2-piperidin-3-ylprop-2-enoic acid
CID 117266899
(3-ethylcyclohexyl)-pyrrolidin-3-ylmethanone
CID 116568230
(3S)-N-cyclopentyl-N-methylpiperidine-3-carboxamide
CID 81123260
(3S)-N-methoxy-N-methylpiperidine-3-carboxamide
CID 81140301

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-[(3R)-piperidin-3-yl]methanone?
The IUPAC name of cyclobutyl-[(3R)-piperidin-3-yl]methanone (CID 124604189) is cyclobutyl-[(3R)-piperidin-3-yl]methanone.
What is the SMILES notation for cyclobutyl-[(3R)-piperidin-3-yl]methanone?
The canonical SMILES for cyclobutyl-[(3R)-piperidin-3-yl]methanone is O=C(C1CCC1)[C@@H]1CCCNC1.
What is the InChIKey of cyclobutyl-[(3R)-piperidin-3-yl]methanone?
The InChIKey is VAVVBTHSORKQLF-SECBINFHSA-N. The full InChI is InChI=1S/C10H17NO/c12-10(8-3-1-4-8)9-5-2-6-11-7-9/h8-9,11H,1-7H2/t9-/m1/s1.
What are the key properties of cyclobutyl-[(3R)-piperidin-3-yl]methanone?
cyclobutyl-[(3R)-piperidin-3-yl]methanone has a molecular weight of 167.25 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-[(3R)-piperidin-3-yl]methanone is sourced from PubChem (CID 124604189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).