2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine

C10H21NO — CID 71757966

IUPAC2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine
SMILESCCC1(CC)C(N)C(C)C1OC
InChIInChI=1S/C10H21NO/c1-5-10(6-2)8(11)7(3)9(10)12-4/h7-9H,5-6,11H2,1-4H3
InChIKeyMZIZHDQBQJLHFU-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.78
Rot. Bonds3

About 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine

2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine (PubChem CID 71757966) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine.

Molecular Properties

Compound Name2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine
PubChem CID71757966
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine
SMILESCCC1(CC)C(N)C(C)C1OC
InChIInChI=1S/C10H21NO/c1-5-10(6-2)8(11)7(3)9(10)12-4/h7-9H,5-6,11H2,1-4H3
InChIKeyMZIZHDQBQJLHFU-UHFFFAOYSA-N
XLogP1.78
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine?
The IUPAC name of 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine (CID 71757966) is 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine.
What is the SMILES notation for 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine?
The canonical SMILES for 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine is CCC1(CC)C(N)C(C)C1OC.
What is the InChIKey of 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine?
The InChIKey is MZIZHDQBQJLHFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-5-10(6-2)8(11)7(3)9(10)12-4/h7-9H,5-6,11H2,1-4H3.
What are the key properties of 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine?
2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine has a molecular weight of 171.28 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-3-methoxy-4-methylcyclobutan-1-amine is sourced from PubChem (CID 71757966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).