3,3-diethylcyclobutan-1-amine;hydrochloride

C8H18ClN — CID 122236546

IUPAC3,3-diethylcyclobutan-1-amine;hydrochloride
SMILESCCC1(CC)CC(N)C1.Cl
InChIInChI=1S/C8H17N.ClH/c1-3-8(4-2)5-7(9)6-8;/h7H,3-6,9H2,1-2H3;1H
InChIKeyQPTDLNLKNKCYFA-UHFFFAOYSA-N
MW163.69 g/mol
LogP2.34
Rot. Bonds2

About 3,3-diethylcyclobutan-1-amine;hydrochloride

3,3-diethylcyclobutan-1-amine;hydrochloride (PubChem CID 122236546) has the molecular formula C8H18ClN and a molecular weight of 163.69 g/mol. Its IUPAC name is 3,3-diethylcyclobutan-1-amine;hydrochloride.

Molecular Properties

Compound Name3,3-diethylcyclobutan-1-amine;hydrochloride
PubChem CID122236546
Molecular FormulaC8H18ClN
Molecular Weight163.69 g/mol
Exact Mass163.11
IUPAC Name3,3-diethylcyclobutan-1-amine;hydrochloride
SMILESCCC1(CC)CC(N)C1.Cl
InChIInChI=1S/C8H17N.ClH/c1-3-8(4-2)5-7(9)6-8;/h7H,3-6,9H2,1-2H3;1H
InChIKeyQPTDLNLKNKCYFA-UHFFFAOYSA-N
XLogP2.34
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.69
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3-diethylcyclobutan-1-amine;hydrochloride?
The IUPAC name of 3,3-diethylcyclobutan-1-amine;hydrochloride (CID 122236546) is 3,3-diethylcyclobutan-1-amine;hydrochloride.
What is the SMILES notation for 3,3-diethylcyclobutan-1-amine;hydrochloride?
The canonical SMILES for 3,3-diethylcyclobutan-1-amine;hydrochloride is CCC1(CC)CC(N)C1.Cl.
What is the InChIKey of 3,3-diethylcyclobutan-1-amine;hydrochloride?
The InChIKey is QPTDLNLKNKCYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.ClH/c1-3-8(4-2)5-7(9)6-8;/h7H,3-6,9H2,1-2H3;1H.
What are the key properties of 3,3-diethylcyclobutan-1-amine;hydrochloride?
3,3-diethylcyclobutan-1-amine;hydrochloride has a molecular weight of 163.69 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethylcyclobutan-1-amine;hydrochloride is sourced from PubChem (CID 122236546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).