3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine

C13H25N — CID 103578466

IUPAC3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine
SMILESCCCC1CC1NC1CC(C(C)C)C1
InChIInChI=1S/C13H25N/c1-4-5-10-8-13(10)14-12-6-11(7-12)9(2)3/h9-14H,4-8H2,1-3H3
InChIKeyZPFVVHOCHAXSQX-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.20
Rot. Bonds5

About 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine

3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine (PubChem CID 103578466) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine
PubChem CID103578466
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine
SMILESCCCC1CC1NC1CC(C(C)C)C1
InChIInChI=1S/C13H25N/c1-4-5-10-8-13(10)14-12-6-11(7-12)9(2)3/h9-14H,4-8H2,1-3H3
InChIKeyZPFVVHOCHAXSQX-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-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-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine?
The IUPAC name of 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine (CID 103578466) is 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine.
What is the SMILES notation for 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine?
The canonical SMILES for 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine is CCCC1CC1NC1CC(C(C)C)C1.
What is the InChIKey of 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine?
The InChIKey is ZPFVVHOCHAXSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-4-5-10-8-13(10)14-12-6-11(7-12)9(2)3/h9-14H,4-8H2,1-3H3.
What are the key properties of 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine?
3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yl-N-(2-propylcyclopropyl)cyclobutan-1-amine is sourced from PubChem (CID 103578466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).