(2S)-2-methylpiperidine

C6H13N — CID 6427443

IUPAC(2S)-2-methylpiperidine
SMILESC[C@H]1CCCCN1
InChIInChI=1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3/t6-/m0/s1
InChIKeyNNWUEBIEOFQMSS-LURJTMIESA-N
MW99.18 g/mol
LogP1.15
Rot. Bonds

About (2S)-2-methylpiperidine

(2S)-2-methylpiperidine (PubChem CID 6427443) has the molecular formula C6H13N and a molecular weight of 99.18 g/mol. Its IUPAC name is (2S)-2-methylpiperidine.

Molecular Properties

Compound Name(2S)-2-methylpiperidine
PubChem CID6427443
Molecular FormulaC6H13N
Molecular Weight99.18 g/mol
Exact Mass99.10
IUPAC Name(2S)-2-methylpiperidine
SMILESC[C@H]1CCCCN1
InChIInChI=1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3/t6-/m0/s1
InChIKeyNNWUEBIEOFQMSS-LURJTMIESA-N
XLogP1.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.18
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-methylpiperidine?
The IUPAC name of (2S)-2-methylpiperidine (CID 6427443) is (2S)-2-methylpiperidine.
What is the SMILES notation for (2S)-2-methylpiperidine?
The canonical SMILES for (2S)-2-methylpiperidine is C[C@H]1CCCCN1.
What is the InChIKey of (2S)-2-methylpiperidine?
The InChIKey is NNWUEBIEOFQMSS-LURJTMIESA-N. The full InChI is InChI=1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3/t6-/m0/s1.
What are the key properties of (2S)-2-methylpiperidine?
(2S)-2-methylpiperidine has a molecular weight of 99.18 g/mol, XLogP of 1.15, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methylpiperidine is sourced from PubChem (CID 6427443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).