3,3-dimethylcyclobutan-1-amine

C6H13N — CID 14988402

IUPAC3,3-dimethylcyclobutan-1-amine
SMILESCC1(C)CC(N)C1
InChIInChI=1S/C6H13N/c1-6(2)3-5(7)4-6/h5H,3-4,7H2,1-2H3
InChIKeyZZIYOZFERMXGHB-UHFFFAOYSA-N
MW99.18 g/mol
LogP1.13
Rot. Bonds

About 3,3-dimethylcyclobutan-1-amine

3,3-dimethylcyclobutan-1-amine (PubChem CID 14988402) has the molecular formula C6H13N and a molecular weight of 99.18 g/mol. Its IUPAC name is 3,3-dimethylcyclobutan-1-amine.

Molecular Properties

Compound Name3,3-dimethylcyclobutan-1-amine
PubChem CID14988402
Molecular FormulaC6H13N
Molecular Weight99.18 g/mol
Exact Mass99.10
IUPAC Name3,3-dimethylcyclobutan-1-amine
SMILESCC1(C)CC(N)C1
InChIInChI=1S/C6H13N/c1-6(2)3-5(7)4-6/h5H,3-4,7H2,1-2H3
InChIKeyZZIYOZFERMXGHB-UHFFFAOYSA-N
XLogP1.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.18
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3,3-dimethylcyclobutan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethylcyclobutan-1-amine?
The IUPAC name of 3,3-dimethylcyclobutan-1-amine (CID 14988402) is 3,3-dimethylcyclobutan-1-amine.
What is the SMILES notation for 3,3-dimethylcyclobutan-1-amine?
The canonical SMILES for 3,3-dimethylcyclobutan-1-amine is CC1(C)CC(N)C1.
What is the InChIKey of 3,3-dimethylcyclobutan-1-amine?
The InChIKey is ZZIYOZFERMXGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N/c1-6(2)3-5(7)4-6/h5H,3-4,7H2,1-2H3.
What are the key properties of 3,3-dimethylcyclobutan-1-amine?
3,3-dimethylcyclobutan-1-amine has a molecular weight of 99.18 g/mol, XLogP of 1.13, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethylcyclobutan-1-amine is sourced from PubChem (CID 14988402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).