4,4-diethylpiperidine;hydrochloride

C9H20ClN — CID 75419509

IUPAC4,4-diethylpiperidine;hydrochloride
SMILESCCC1(CC)CCNCC1.Cl
InChIInChI=1S/C9H19N.ClH/c1-3-9(4-2)5-7-10-8-6-9;/h10H,3-8H2,1-2H3;1H
InChIKeyYSNWSGQDWUSLKF-UHFFFAOYSA-N
MW177.72 g/mol
LogP2.60
Rot. Bonds2

About 4,4-diethylpiperidine;hydrochloride

4,4-diethylpiperidine;hydrochloride (PubChem CID 75419509) has the molecular formula C9H20ClN and a molecular weight of 177.72 g/mol. Its IUPAC name is 4,4-diethylpiperidine;hydrochloride.

Molecular Properties

Compound Name4,4-diethylpiperidine;hydrochloride
PubChem CID75419509
Molecular FormulaC9H20ClN
Molecular Weight177.72 g/mol
Exact Mass177.13
IUPAC Name4,4-diethylpiperidine;hydrochloride
SMILESCCC1(CC)CCNCC1.Cl
InChIInChI=1S/C9H19N.ClH/c1-3-9(4-2)5-7-10-8-6-9;/h10H,3-8H2,1-2H3;1H
InChIKeyYSNWSGQDWUSLKF-UHFFFAOYSA-N
XLogP2.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.72
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;N-[(4-ethylpiperidin-4-yl)methyl]ethanamine
CID 143578873
N-[(4-ethylpiperidin-4-yl)methyl]-N-propylpropan-1-amine
CID 63129554
4-ethylpiperidin-4-amine;dihydrochloride
CID 86276736
3,3-diethylazetidine;hydrochloride
CID 119032125
ethyl 2-(4-ethylpiperidin-4-yl)acetate
CID 167523554
4-ethylpiperidine-4-thiol
CID 54175704
1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine
CID 63129487
4-[(4-ethylpiperidin-4-yl)methyl]-1,4-thiazinane 1-oxide
CID 63129878
1,1-diethylcyclopropane;ethane;propane
CID 162386463
4-ethylpiperidine-4-carbonitrile;hydrochloride
CID 75531112
4,4-bis(fluoromethyl)piperidine
CID 153409538
3-ethyl-3-(2-methylbutyl)pyrrolidine
CID 62352988

Frequently Asked Questions

What is the IUPAC name of 4,4-diethylpiperidine;hydrochloride?
The IUPAC name of 4,4-diethylpiperidine;hydrochloride (CID 75419509) is 4,4-diethylpiperidine;hydrochloride.
What is the SMILES notation for 4,4-diethylpiperidine;hydrochloride?
The canonical SMILES for 4,4-diethylpiperidine;hydrochloride is CCC1(CC)CCNCC1.Cl.
What is the InChIKey of 4,4-diethylpiperidine;hydrochloride?
The InChIKey is YSNWSGQDWUSLKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.ClH/c1-3-9(4-2)5-7-10-8-6-9;/h10H,3-8H2,1-2H3;1H.
What are the key properties of 4,4-diethylpiperidine;hydrochloride?
4,4-diethylpiperidine;hydrochloride has a molecular weight of 177.72 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diethylpiperidine;hydrochloride is sourced from PubChem (CID 75419509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).