1,4-diethylpiperidine;ethane

C13H31N — CID 143709904

IUPAC1,4-diethylpiperidine;ethane
SMILESCC.CC.CCC1CCN(CC)CC1
InChIInChI=1S/C9H19N.2C2H6/c1-3-9-5-7-10(4-2)8-6-9;2*1-2/h9H,3-8H2,1-2H3;2*1-2H3
InChIKeyMPWJZNGGIHUULB-UHFFFAOYSA-N
MW201.40 g/mol
LogP4.18
Rot. Bonds2

About 1,4-diethylpiperidine;ethane

1,4-diethylpiperidine;ethane (PubChem CID 143709904) has the molecular formula C13H31N and a molecular weight of 201.40 g/mol. Its IUPAC name is 1,4-diethylpiperidine;ethane.

Molecular Properties

Compound Name1,4-diethylpiperidine;ethane
PubChem CID143709904
Molecular FormulaC13H31N
Molecular Weight201.40 g/mol
Exact Mass201.25
IUPAC Name1,4-diethylpiperidine;ethane
SMILESCC.CC.CCC1CCN(CC)CC1
InChIInChI=1S/C9H19N.2C2H6/c1-3-9-5-7-10(4-2)8-6-9;2*1-2/h9H,3-8H2,1-2H3;2*1-2H3
InChIKeyMPWJZNGGIHUULB-UHFFFAOYSA-N
XLogP4.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.40
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,4-diethylazepane
CID 67522864
1,4-diethylpiperidine;1-ethyl-4-methylpiperazine
CID 143157970
1,3-diethylpyrrolidine;ethane
CID 145103245
1,3-diethylpyrrolidine;ethane;molecular hydrogen
CID 143628979
ethane;1-(4-ethylpiperazin-1-yl)-2-(4-ethylpiperidin-1-yl)ethanone
CID 162725519
1,3-diethylpyrrolidine;formonitrile
CID 175874911
ethane;2-(4-ethylpiperidin-1-yl)ethanol
CID 143029211
ethane;1-ethyl-4-methylpiperidine
CID 143737046
benzene;ethane;1-ethyl-4-propylpiperidine
CID 90839666
N-[(1-ethylpiperidin-4-yl)methyl]-N-propylpropan-1-amine
CID 170705762
1-[2-(azetidin-1-yl)ethyl]-4-ethylazocane;ethane
CID 143029154
ethane;1-[(1-ethylpiperidin-4-yl)methyl]-4-methylpiperazine
CID 163403762

Frequently Asked Questions

What is the IUPAC name of 1,4-diethylpiperidine;ethane?
The IUPAC name of 1,4-diethylpiperidine;ethane (CID 143709904) is 1,4-diethylpiperidine;ethane.
What is the SMILES notation for 1,4-diethylpiperidine;ethane?
The canonical SMILES for 1,4-diethylpiperidine;ethane is CC.CC.CCC1CCN(CC)CC1.
What is the InChIKey of 1,4-diethylpiperidine;ethane?
The InChIKey is MPWJZNGGIHUULB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.2C2H6/c1-3-9-5-7-10(4-2)8-6-9;2*1-2/h9H,3-8H2,1-2H3;2*1-2H3.
What are the key properties of 1,4-diethylpiperidine;ethane?
1,4-diethylpiperidine;ethane has a molecular weight of 201.40 g/mol, XLogP of 4.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-diethylpiperidine;ethane is sourced from PubChem (CID 143709904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).