4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine

C12H24N2 — CID 148627531

IUPAC4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine
SMILESCC(C)[C@H]1CCN(C2CCNCC2)C1
InChIInChI=1S/C12H24N2/c1-10(2)11-5-8-14(9-11)12-3-6-13-7-4-12/h10-13H,3-9H2,1-2H3/t11-/m0/s1
InChIKeyNHMOGJSYJZBQAK-NSHDSACASA-N
MW196.34 g/mol
LogP1.72
Rot. Bonds2

About 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine

4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine (PubChem CID 148627531) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine.

Molecular Properties

Compound Name4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine
PubChem CID148627531
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine
SMILESCC(C)[C@H]1CCN(C2CCNCC2)C1
InChIInChI=1S/C12H24N2/c1-10(2)11-5-8-14(9-11)12-3-6-13-7-4-12/h10-13H,3-9H2,1-2H3/t11-/m0/s1
InChIKeyNHMOGJSYJZBQAK-NSHDSACASA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-1-cyclopropyl-3-propan-2-ylpyrrolidine
CID 176871343
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CID 103983594
(1R)-1-[(3S)-1-piperidin-4-ylpiperidin-3-yl]ethanol
CID 129494886
1-cycloheptyl-3-propan-2-ylpiperidine
CID 163393179
3-(4-propan-2-ylcyclohexyl)-3,9-diazabicyclo[4.2.1]nonane
CID 113284769
(3S,4S)-3-methyl-1-piperidin-4-ylpiperidin-4-ol
CID 129381092
4-(3-propan-2-yloxyazetidin-1-yl)piperidine
CID 165137424
(3R,4R)-4-(3-propan-2-ylpyrrolidin-1-yl)pyrrolidin-3-ol
CID 122236872
4-methyl-1-piperidin-4-ylpiperidine;dihydrochloride
CID 56831594
3-methyl-1-piperidin-4-ylpiperidine
CID 2760044
propan-2-yl 1-piperidin-4-ylpiperidine-4-carboxylate
CID 23117201
piperidin-4-yl-(3-propan-2-ylpyrrolidin-1-yl)methanone;hydrochloride
CID 119344916

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine?
The IUPAC name of 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine (CID 148627531) is 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine.
What is the SMILES notation for 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine?
The canonical SMILES for 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine is CC(C)[C@H]1CCN(C2CCNCC2)C1.
What is the InChIKey of 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine?
The InChIKey is NHMOGJSYJZBQAK-NSHDSACASA-N. The full InChI is InChI=1S/C12H24N2/c1-10(2)11-5-8-14(9-11)12-3-6-13-7-4-12/h10-13H,3-9H2,1-2H3/t11-/m0/s1.
What are the key properties of 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine?
4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine has a molecular weight of 196.34 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-3-propan-2-ylpyrrolidin-1-yl]piperidine is sourced from PubChem (CID 148627531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).