(2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone

C13H22N2O — CID 119493995

IUPAC(2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone
SMILESCNC1CCCN(C(=O)C2CC2C2CC2)C1
InChIInChI=1S/C13H22N2O/c1-14-10-3-2-6-15(8-10)13(16)12-7-11(12)9-4-5-9/h9-12,14H,2-8H2,1H3
InChIKeyTWRNJHJZRARXGJ-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.24
Rot. Bonds3

About (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone

(2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone (PubChem CID 119493995) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone
PubChem CID119493995
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name(2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone
SMILESCNC1CCCN(C(=O)C2CC2C2CC2)C1
InChIInChI=1S/C13H22N2O/c1-14-10-3-2-6-15(8-10)13(16)12-7-11(12)9-4-5-9/h9-12,14H,2-8H2,1H3
InChIKeyTWRNJHJZRARXGJ-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl-[(3S)-3-(methylamino)piperidin-1-yl]methanone
CID 94475773
cyclohexyl-[(3S)-3-(methylamino)piperidin-1-yl]methanone
CID 94475779
[3-(1-aminoethyl)piperidin-1-yl]-(2-cyclohexylcyclopropyl)methanone
CID 119593107
cyclooctyl-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119493060
1-[(3S)-3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 172646124
[3-(methylamino)piperidin-1-yl]-[1-(pyrrolidine-1-carbonyl)piperidin-4-yl]methanone;hydrochloride
CID 119491186
(2S)-2-[3-(methylamino)piperidine-1-carbonyl]pyrrolidine-1-carboxamide;hydrochloride
CID 119490463
[3-(methylamino)piperidin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 104856209
[3-(methylamino)piperidin-1-yl]-(oxan-4-yl)methanone;hydrochloride
CID 119487408
1-[(3S)-3-(methylamino)piperidin-1-yl]propan-1-one
CID 94475711
(4-tert-butylcyclohexyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 62718074
(3S)-3-(methylamino)-N-propan-2-ylpiperidine-1-carboxamide
CID 94475900

Frequently Asked Questions

What is the IUPAC name of (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone?
The IUPAC name of (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone (CID 119493995) is (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone?
The canonical SMILES for (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone is CNC1CCCN(C(=O)C2CC2C2CC2)C1.
What is the InChIKey of (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone?
The InChIKey is TWRNJHJZRARXGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-14-10-3-2-6-15(8-10)13(16)12-7-11(12)9-4-5-9/h9-12,14H,2-8H2,1H3.
What are the key properties of (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone?
(2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone has a molecular weight of 222.33 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropylcyclopropyl)-[3-(methylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 119493995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).