ethane;2-ethyl-2,6-dimethylpiperidine

C13H31N — CID 143770628

IUPACethane;2-ethyl-2,6-dimethylpiperidine
SMILESCC.CC.CCC1(C)CCCC(C)N1
InChIInChI=1S/C9H19N.2C2H6/c1-4-9(3)7-5-6-8(2)10-9;2*1-2/h8,10H,4-7H2,1-3H3;2*1-2H3
InChIKeyCPYDXTOFTURKJP-UHFFFAOYSA-N
MW201.40 g/mol
LogP4.37
Rot. Bonds1

About ethane;2-ethyl-2,6-dimethylpiperidine

ethane;2-ethyl-2,6-dimethylpiperidine (PubChem CID 143770628) has the molecular formula C13H31N and a molecular weight of 201.40 g/mol. Its IUPAC name is ethane;2-ethyl-2,6-dimethylpiperidine.

Molecular Properties

Compound Nameethane;2-ethyl-2,6-dimethylpiperidine
PubChem CID143770628
Molecular FormulaC13H31N
Molecular Weight201.40 g/mol
Exact Mass201.25
IUPAC Nameethane;2-ethyl-2,6-dimethylpiperidine
SMILESCC.CC.CCC1(C)CCCC(C)N1
InChIInChI=1S/C9H19N.2C2H6/c1-4-9(3)7-5-6-8(2)10-9;2*1-2/h8,10H,4-7H2,1-3H3;2*1-2H3
InChIKeyCPYDXTOFTURKJP-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.40
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-tert-butyl-1-ethyl-1-methylcyclopentane
CID 123149703
1,3-diethyl-1,2-dimethylcyclohexane
CID 123496519
1-ethyl-1,4-dimethylcycloheptane
CID 91266372
3,7,7-trimethyloxazepane
CID 91048926
(3S)-1-ethyl-1,3-dimethylcyclohexane
CID 145106781
2-methyl-1-azaspiro[4.5]decane
CID 59976686
5-methyl-4-azaspiro[2.4]heptane
CID 82418982
ethane;3-ethyl-1,1,2-trimethylcyclohexane;propane
CID 176966698
7a-ethyl-1,2,3,4,4a,5,6,7-octahydrocyclopenta[b]pyridine
CID 83680079
1-(2,2-dimethylcyclopentyl)-3-ethyl-3-methylpiperazine
CID 79878488
1,1-diethyl-3-methylcyclohexane
CID 19090157
[(1S,2R)-1,2-dimethylcyclopentyl]methanol
CID 167089966

Frequently Asked Questions

What is the IUPAC name of ethane;2-ethyl-2,6-dimethylpiperidine?
The IUPAC name of ethane;2-ethyl-2,6-dimethylpiperidine (CID 143770628) is ethane;2-ethyl-2,6-dimethylpiperidine.
What is the SMILES notation for ethane;2-ethyl-2,6-dimethylpiperidine?
The canonical SMILES for ethane;2-ethyl-2,6-dimethylpiperidine is CC.CC.CCC1(C)CCCC(C)N1.
What is the InChIKey of ethane;2-ethyl-2,6-dimethylpiperidine?
The InChIKey is CPYDXTOFTURKJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.2C2H6/c1-4-9(3)7-5-6-8(2)10-9;2*1-2/h8,10H,4-7H2,1-3H3;2*1-2H3.
What are the key properties of ethane;2-ethyl-2,6-dimethylpiperidine?
ethane;2-ethyl-2,6-dimethylpiperidine has a molecular weight of 201.40 g/mol, XLogP of 4.37, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethyl-2,6-dimethylpiperidine is sourced from PubChem (CID 143770628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).