[2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone

C12H22N2O — CID 90327212

IUPAC[2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone
SMILESCNC1CC(C(=O)N2CCCC2)C1(C)C
InChIInChI=1S/C12H22N2O/c1-12(2)9(8-10(12)13-3)11(15)14-6-4-5-7-14/h9-10,13H,4-8H2,1-3H3
InChIKeyGCJWUGAUPPMOGU-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.24
Rot. Bonds2

About [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone

[2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone (PubChem CID 90327212) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone
PubChem CID90327212
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name[2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone
SMILESCNC1CC(C(=O)N2CCCC2)C1(C)C
InChIInChI=1S/C12H22N2O/c1-12(2)9(8-10(12)13-3)11(15)14-6-4-5-7-14/h9-10,13H,4-8H2,1-3H3
InChIKeyGCJWUGAUPPMOGU-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S,3R)-2,2-dimethyl-3-(methylamino)cyclobutyl]-piperidin-1-ylmethanone
CID 90327192
1-[2,2-dimethyl-3-(pyrrolidine-1-carbonyl)cyclobutyl]ethanone
CID 12760010
(3-hydroxy-3-methylazetidin-1-yl)-[3-(methylamino)cyclobutyl]methanone
CID 164651387
[2-(pyrrolidine-1-carbonyl)cyclopropyl]-pyrrolidin-1-ylmethanone
CID 109131791
1,2,2-trimethyl-3-(pyrrolidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 5268669
1-[(1R,3S)-2,2-dimethyl-3-(phenylmethoxycarbonylamino)cyclobutanecarbonyl]piperidine-4-carboxylic acid
CID 141434196
[(2R)-2-fluorocyclopropyl]-pyrrolidin-1-ylmethanone
CID 139324368
azetidin-1-yl-(2-methyl-2-propan-2-ylcyclopropyl)methanone
CID 130718788
[2-(azepane-1-carbonyl)cyclopropyl]-(azepan-1-yl)methanone
CID 109140675
cyclopentyl-[4-(methylamino)piperidin-1-yl]methanone
CID 60820118
(4-chloropiperidin-1-yl)-(2,2-dimethylcyclopropyl)methanone
CID 107003166
[(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone
CID 154357198

Frequently Asked Questions

What is the IUPAC name of [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone (CID 90327212) is [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone is CNC1CC(C(=O)N2CCCC2)C1(C)C.
What is the InChIKey of [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone?
The InChIKey is GCJWUGAUPPMOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-12(2)9(8-10(12)13-3)11(15)14-6-4-5-7-14/h9-10,13H,4-8H2,1-3H3.
What are the key properties of [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone?
[2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone has a molecular weight of 210.32 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2,2-dimethyl-3-(methylamino)cyclobutyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 90327212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).