2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine

C11H23N — CID 164656547

IUPAC2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine
SMILESCC(C)C(C)C1CC(N)C1(C)C
InChIInChI=1S/C11H23N/c1-7(2)8(3)9-6-10(12)11(9,4)5/h7-10H,6,12H2,1-5H3
InChIKeyBEHLKIBKASTBCU-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.65
Rot. Bonds2

About 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine

2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine (PubChem CID 164656547) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine
PubChem CID164656547
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine
SMILESCC(C)C(C)C1CC(N)C1(C)C
InChIInChI=1S/C11H23N/c1-7(2)8(3)9-6-10(12)11(9,4)5/h7-10H,6,12H2,1-5H3
InChIKeyBEHLKIBKASTBCU-UHFFFAOYSA-N
XLogP2.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine?
The IUPAC name of 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine (CID 164656547) is 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine.
What is the SMILES notation for 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine?
The canonical SMILES for 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine is CC(C)C(C)C1CC(N)C1(C)C.
What is the InChIKey of 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine?
The InChIKey is BEHLKIBKASTBCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-7(2)8(3)9-6-10(12)11(9,4)5/h7-10H,6,12H2,1-5H3.
What are the key properties of 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine?
2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(3-methylbutan-2-yl)cyclobutan-1-amine is sourced from PubChem (CID 164656547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).