3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine

C13H25NO — CID 106207259

IUPAC3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine
SMILESCCC1(CC)C(N)CC1OCCC1CC1
InChIInChI=1S/C13H25NO/c1-3-13(4-2)11(14)9-12(13)15-8-7-10-5-6-10/h10-12H,3-9,14H2,1-2H3
InChIKeyMJNHWVQPCBNOEK-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.71
Rot. Bonds6

About 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine

3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine (PubChem CID 106207259) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine.

Molecular Properties

Compound Name3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine
PubChem CID106207259
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine
SMILESCCC1(CC)C(N)CC1OCCC1CC1
InChIInChI=1S/C13H25NO/c1-3-13(4-2)11(14)9-12(13)15-8-7-10-5-6-10/h10-12H,3-9,14H2,1-2H3
InChIKeyMJNHWVQPCBNOEK-UHFFFAOYSA-N
XLogP2.71
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine?
The IUPAC name of 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine (CID 106207259) is 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine.
What is the SMILES notation for 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine?
The canonical SMILES for 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine is CCC1(CC)C(N)CC1OCCC1CC1.
What is the InChIKey of 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine?
The InChIKey is MJNHWVQPCBNOEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-3-13(4-2)11(14)9-12(13)15-8-7-10-5-6-10/h10-12H,3-9,14H2,1-2H3.
What are the key properties of 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine?
3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine has a molecular weight of 211.35 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclopropylethoxy)-2,2-diethylcyclobutan-1-amine is sourced from PubChem (CID 106207259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).