1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine

C17H38N2 — CID 142886839

IUPAC1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine
SMILESCC.CC1CCCC(C)N1C.CC1CCCCN1C
InChIInChI=1S/C8H17N.C7H15N.C2H6/c1-7-5-4-6-8(2)9(7)3;1-7-5-3-4-6-8(7)2;1-2/h7-8H,4-6H2,1-3H3;7H,3-6H2,1-2H3;1-2H3
InChIKeyYKPAMTXUGQJMTA-UHFFFAOYSA-N
MW270.50 g/mol
LogP4.40
Rot. Bonds

About 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine

1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine (PubChem CID 142886839) has the molecular formula C17H38N2 and a molecular weight of 270.50 g/mol. Its IUPAC name is 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine.

Molecular Properties

Compound Name1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine
PubChem CID142886839
Molecular FormulaC17H38N2
Molecular Weight270.50 g/mol
Exact Mass270.30
IUPAC Name1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine
SMILESCC.CC1CCCC(C)N1C.CC1CCCCN1C
InChIInChI=1S/C8H17N.C7H15N.C2H6/c1-7-5-4-6-8(2)9(7)3;1-7-5-3-4-6-8(7)2;1-2/h7-8H,4-6H2,1-3H3;7H,3-6H2,1-2H3;1-2H3
InChIKeyYKPAMTXUGQJMTA-UHFFFAOYSA-N
XLogP4.40
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.50
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(9-Piperidin-1-ylnonyl)piperidine
CID 11500302
1-(6-Piperidin-1-ylhexyl)piperidine
CID 23723171
(2R)-1-methyl-2-(2-piperidin-1-ylethyl)piperidine
CID 3246106
1-Methyl-2-[2-(1-piperidinyl)ethyl]piperidine
CID 410260
1,6-Dipiperidinohexane
CID 1825862
9-Azabicyclo(3.3.1)nonane, 9-methyl-
CID 136318
1,1'-Sulfanediylbis(2-ethyl-1-methylpiperidin-1-ium) dichloride
CID 115641
1,1'-Sulfinylbis(2-ethyl-1-methylpiperidin-1-ium) dichloride
CID 115643
1,1'-(Decane-1,10-diyl)bis(1-ethylpiperidin-1-ium) dibromide
CID 3048051
1,1'-(Decane-1,10-diyl)bis(1-methylpiperidin-1-ium) diiodide
CID 3048053
1,1'-(Heptane-1,7-diyl)bis(1-methylpiperidin-1-ium) diiodide
CID 3048295
1,1'-(Hexane-1,6-diyl)bis(1-ethylpiperidin-1-ium) diiodide
CID 3048297

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine?
The IUPAC name of 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine (CID 142886839) is 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine.
What is the SMILES notation for 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine?
The canonical SMILES for 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine is CC.CC1CCCC(C)N1C.CC1CCCCN1C.
What is the InChIKey of 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine?
The InChIKey is YKPAMTXUGQJMTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.C7H15N.C2H6/c1-7-5-4-6-8(2)9(7)3;1-7-5-3-4-6-8(7)2;1-2/h7-8H,4-6H2,1-3H3;7H,3-6H2,1-2H3;1-2H3.
What are the key properties of 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine?
1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine has a molecular weight of 270.50 g/mol, XLogP of 4.40, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylpiperidine;ethane;1,2,6-trimethylpiperidine is sourced from PubChem (CID 142886839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).