di(piperidin-3-yl)methanone

C11H20N2O — CID 69183047

IUPACdi(piperidin-3-yl)methanone
SMILESO=C(C1CCCNC1)C1CCCNC1
InChIInChI=1S/C11H20N2O/c14-11(9-3-1-5-12-7-9)10-4-2-6-13-8-10/h9-10,12-13H,1-8H2
InChIKeyRMIHGNQFQZKPPB-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.55
Rot. Bonds2

About di(piperidin-3-yl)methanone

di(piperidin-3-yl)methanone (PubChem CID 69183047) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is di(piperidin-3-yl)methanone.

Molecular Properties

Compound Namedi(piperidin-3-yl)methanone
PubChem CID69183047
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Namedi(piperidin-3-yl)methanone
SMILESO=C(C1CCCNC1)C1CCCNC1
InChIInChI=1S/C11H20N2O/c14-11(9-3-1-5-12-7-9)10-4-2-6-13-8-10/h9-10,12-13H,1-8H2
InChIKeyRMIHGNQFQZKPPB-UHFFFAOYSA-N
XLogP0.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cyclobutyl-[(3R)-piperidin-3-yl]methanone
CID 124604189
[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone
CID 124675211
(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,N-dimethylpiperidine-3-carboxamide
CID 11469201
2-piperidin-3-ylprop-2-enoic acid
CID 117266899
(3S)-N-methoxy-N-methylpiperidine-3-carboxamide
CID 81140301
azepan-1-yl-[(3S)-piperidin-3-yl]methanone
CID 7169846
ethane;(3R)-N-methylpiperidine-3-carboxamide
CID 145422305
azocan-1-yl(piperidin-3-yl)methanone
CID 43211901
(3S)-N-cyclobutylpiperidine-3-carboxamide
CID 81141296

Frequently Asked Questions

What is the IUPAC name of di(piperidin-3-yl)methanone?
The IUPAC name of di(piperidin-3-yl)methanone (CID 69183047) is di(piperidin-3-yl)methanone.
What is the SMILES notation for di(piperidin-3-yl)methanone?
The canonical SMILES for di(piperidin-3-yl)methanone is O=C(C1CCCNC1)C1CCCNC1.
What is the InChIKey of di(piperidin-3-yl)methanone?
The InChIKey is RMIHGNQFQZKPPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c14-11(9-3-1-5-12-7-9)10-4-2-6-13-8-10/h9-10,12-13H,1-8H2.
What are the key properties of di(piperidin-3-yl)methanone?
di(piperidin-3-yl)methanone has a molecular weight of 196.29 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for di(piperidin-3-yl)methanone is sourced from PubChem (CID 69183047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).