methane;2-methylpiperidine

C8H21N — CID 159247179

IUPACmethane;2-methylpiperidine
SMILESC.C.CC1CCCCN1
InChIInChI=1S/C6H13N.2CH4/c1-6-4-2-3-5-7-6;;/h6-7H,2-5H2,1H3;2*1H4
InChIKeyKUVCPDKCNZTEPX-UHFFFAOYSA-N
MW131.26 g/mol
LogP2.42
Rot. Bonds

About methane;2-methylpiperidine

methane;2-methylpiperidine (PubChem CID 159247179) has the molecular formula C8H21N and a molecular weight of 131.26 g/mol. Its IUPAC name is methane;2-methylpiperidine.

Molecular Properties

Compound Namemethane;2-methylpiperidine
PubChem CID159247179
Molecular FormulaC8H21N
Molecular Weight131.26 g/mol
Exact Mass131.17
IUPAC Namemethane;2-methylpiperidine
SMILESC.C.CC1CCCCN1
InChIInChI=1S/C6H13N.2CH4/c1-6-4-2-3-5-7-6;;/h6-7H,2-5H2,1H3;2*1H4
InChIKeyKUVCPDKCNZTEPX-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.26
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methylpiperidine
CID 7974
(2S)-2-methylazocane
CID 137404038
(2S)-2-methylpiperidine;(2S)-2-methylpyrrolidine
CID 164977059
(2R)-2-methylazonane
CID 89251055
2-methylpyrrolidine
CID 13003
2-methylpyrrolidine
CID 142041388
ethane;methyl formate;(2S)-2-methylpiperidine
CID 162751563
2-methylpiperidine;oxan-4-amine
CID 142432277
2,3-dihydroxybutanedioic acid;(2R)-2-methylpiperidine
CID 21041485
formic acid;(2R)-2-methylpyrrolidine
CID 143602308
(2R,7S)-2,7-dimethylazocane
CID 146199429
2-methyl-1,5,9-triazacyclododecane
CID 22113611

Frequently Asked Questions

What is the IUPAC name of methane;2-methylpiperidine?
The IUPAC name of methane;2-methylpiperidine (CID 159247179) is methane;2-methylpiperidine.
What is the SMILES notation for methane;2-methylpiperidine?
The canonical SMILES for methane;2-methylpiperidine is C.C.CC1CCCCN1.
What is the InChIKey of methane;2-methylpiperidine?
The InChIKey is KUVCPDKCNZTEPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.2CH4/c1-6-4-2-3-5-7-6;;/h6-7H,2-5H2,1H3;2*1H4.
What are the key properties of methane;2-methylpiperidine?
methane;2-methylpiperidine has a molecular weight of 131.26 g/mol, XLogP of 2.42, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-methylpiperidine is sourced from PubChem (CID 159247179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).