4-[(2R)-3,3-dimethylbutan-2-yl]piperidine

C11H23N — CID 146228118

IUPAC4-[(2R)-3,3-dimethylbutan-2-yl]piperidine
SMILESC[C@H](C1CCNCC1)C(C)(C)C
InChIInChI=1S/C11H23N/c1-9(11(2,3)4)10-5-7-12-8-6-10/h9-10,12H,5-8H2,1-4H3/t9-/m1/s1
InChIKeyLNEIQXHRJQHCFO-SECBINFHSA-N
MW169.31 g/mol
LogP2.67
Rot. Bonds1

About 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine

4-[(2R)-3,3-dimethylbutan-2-yl]piperidine (PubChem CID 146228118) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine.

Molecular Properties

Compound Name4-[(2R)-3,3-dimethylbutan-2-yl]piperidine
PubChem CID146228118
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name4-[(2R)-3,3-dimethylbutan-2-yl]piperidine
SMILESC[C@H](C1CCNCC1)C(C)(C)C
InChIInChI=1S/C11H23N/c1-9(11(2,3)4)10-5-7-12-8-6-10/h9-10,12H,5-8H2,1-4H3/t9-/m1/s1
InChIKeyLNEIQXHRJQHCFO-SECBINFHSA-N
XLogP2.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,3-dimethylbutan-2-ylcyclopropane
CID 13275215
4-[(2S)-3-methylbutan-2-yl]piperidine
CID 126758303
4-(3,3-dimethylbutan-2-yl)oxane
CID 58260872
4-(3,4-dimethylpentan-2-yl)piperidine
CID 131198320
3-methyl-2-piperidin-4-ylbutan-1-amine
CID 82598281
4-[(1R)-1-fluoroethyl]piperidine
CID 124547551
3-(2,2,4,4-tetramethylpentan-3-yl)pyrrolidine
CID 146228066
4-[(1R)-1-methoxyethyl]piperidine
CID 95732416
3-piperidin-4-ylbutan-2-ol
CID 154192279
N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine
CID 83909799
4-[(2R)-butan-2-yl]piperidine;ethane
CID 142032949
2-methyl-N-(1-piperidin-4-ylethyl)propane-2-sulfonamide
CID 63688048

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine?
The IUPAC name of 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine (CID 146228118) is 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine.
What is the SMILES notation for 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine?
The canonical SMILES for 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine is C[C@H](C1CCNCC1)C(C)(C)C.
What is the InChIKey of 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine?
The InChIKey is LNEIQXHRJQHCFO-SECBINFHSA-N. The full InChI is InChI=1S/C11H23N/c1-9(11(2,3)4)10-5-7-12-8-6-10/h9-10,12H,5-8H2,1-4H3/t9-/m1/s1.
What are the key properties of 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine?
4-[(2R)-3,3-dimethylbutan-2-yl]piperidine has a molecular weight of 169.31 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-3,3-dimethylbutan-2-yl]piperidine is sourced from PubChem (CID 146228118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).