3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one

C11H19N3O2 — CID 82391645

IUPAC3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one
SMILESCC1NCC(C(=O)C2CCCNC2)NC1=O
InChIInChI=1S/C11H19N3O2/c1-7-11(16)14-9(6-13-7)10(15)8-3-2-4-12-5-8/h7-9,12-13H,2-6H2,1H3,(H,14,16)
InChIKeyDPFBTPJKYVYUBC-UHFFFAOYSA-N
MW225.29 g/mol
LogP-0.97
Rot. Bonds2

About 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one

3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one (PubChem CID 82391645) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one.

Molecular Properties

Compound Name3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one
PubChem CID82391645
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one
SMILESCC1NCC(C(=O)C2CCCNC2)NC1=O
InChIInChI=1S/C11H19N3O2/c1-7-11(16)14-9(6-13-7)10(15)8-3-2-4-12-5-8/h7-9,12-13H,2-6H2,1H3,(H,14,16)
InChIKeyDPFBTPJKYVYUBC-UHFFFAOYSA-N
XLogP-0.97
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 5-0.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

di(piperidin-3-yl)methanone
CID 69183047
cyclobutyl-[(3R)-piperidin-3-yl]methanone
CID 124604189
(2,6-dimethylpiperidin-1-yl)-piperidin-3-ylmethanone
CID 18072139
3-methyl-4-[(3S)-piperidine-3-carbonyl]piperazin-2-one
CID 81139872
(3S)-N,N-dimethylpiperidine-3-carboxamide
CID 11469201
(2-methylpiperidin-1-yl)-[(3R)-piperidin-3-yl]methanone
CID 81123466
(1-methylpyrrolidin-3-yl)-piperidin-3-ylmethanone
CID 116916955
ethane;(3R)-N-methylpiperidine-3-carboxamide
CID 145422305
methyl (3S)-piperidine-3-carboxylate;hydrochloride
CID 57345867
1-piperidin-2-yl-2-piperidin-3-ylethane-1,2-dione
CID 70065866
(3S)-N-methoxy-N-methylpiperidine-3-carboxamide
CID 81140301
[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone
CID 124675211

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one?
The IUPAC name of 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one (CID 82391645) is 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one.
What is the SMILES notation for 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one?
The canonical SMILES for 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one is CC1NCC(C(=O)C2CCCNC2)NC1=O.
What is the InChIKey of 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one?
The InChIKey is DPFBTPJKYVYUBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-7-11(16)14-9(6-13-7)10(15)8-3-2-4-12-5-8/h7-9,12-13H,2-6H2,1H3,(H,14,16).
What are the key properties of 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one?
3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one has a molecular weight of 225.29 g/mol, XLogP of -0.97, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-(piperidine-3-carbonyl)piperazin-2-one is sourced from PubChem (CID 82391645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).