4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine

C12H24N2 — CID 7141723

IUPAC4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine
SMILESCC1CCN(C[C@@H]2CCCCN2)CC1
InChIInChI=1S/C12H24N2/c1-11-5-8-14(9-6-11)10-12-4-2-3-7-13-12/h11-13H,2-10H2,1H3/t12-/m0/s1
InChIKeyVEHLLUFXJVRZFT-LBPRGKRZSA-N
MW196.34 g/mol
LogP1.86
Rot. Bonds2

About 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine

4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine (PubChem CID 7141723) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine.

Molecular Properties

Compound Name4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine
PubChem CID7141723
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine
SMILESCC1CCN(C[C@@H]2CCCCN2)CC1
InChIInChI=1S/C12H24N2/c1-11-5-8-14(9-6-11)10-12-4-2-3-7-13-12/h11-13H,2-10H2,1H3/t12-/m0/s1
InChIKeyVEHLLUFXJVRZFT-LBPRGKRZSA-N
XLogP1.86
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 ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(3R)-3-methyl-1-[[(2R)-piperidin-2-yl]methyl]piperidine
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4-[[(2R)-piperidin-2-yl]methyl]thiomorpholine
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4-propan-2-yl-1-[[(2R)-pyrrolidin-2-yl]methyl]piperidine
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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine?
The IUPAC name of 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine (CID 7141723) is 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine.
What is the SMILES notation for 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine?
The canonical SMILES for 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine is CC1CCN(C[C@@H]2CCCCN2)CC1.
What is the InChIKey of 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine?
The InChIKey is VEHLLUFXJVRZFT-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H24N2/c1-11-5-8-14(9-6-11)10-12-4-2-3-7-13-12/h11-13H,2-10H2,1H3/t12-/m0/s1.
What are the key properties of 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine?
4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine has a molecular weight of 196.34 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine is sourced from PubChem (CID 7141723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).