3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine

C11H21N — CID 146600064

IUPAC3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine
SMILESCC(C)C1CC(C2CC(N)C2)C1
InChIInChI=1S/C11H21N/c1-7(2)8-3-9(4-8)10-5-11(12)6-10/h7-11H,3-6,12H2,1-2H3
InChIKeyUKADAZJTOYWLHQ-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.41
Rot. Bonds2

About 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine

3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine (PubChem CID 146600064) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine
PubChem CID146600064
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine
SMILESCC(C)C1CC(C2CC(N)C2)C1
InChIInChI=1S/C11H21N/c1-7(2)8-3-9(4-8)10-5-11(12)6-10/h7-11H,3-6,12H2,1-2H3
InChIKeyUKADAZJTOYWLHQ-UHFFFAOYSA-N
XLogP2.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine?
The IUPAC name of 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine (CID 146600064) is 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine.
What is the SMILES notation for 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine?
The canonical SMILES for 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine is CC(C)C1CC(C2CC(N)C2)C1.
What is the InChIKey of 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine?
The InChIKey is UKADAZJTOYWLHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-7(2)8-3-9(4-8)10-5-11(12)6-10/h7-11H,3-6,12H2,1-2H3.
What are the key properties of 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine?
3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine has a molecular weight of 167.30 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-propan-2-ylcyclobutyl)cyclobutan-1-amine is sourced from PubChem (CID 146600064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).