(3-tert-butylcyclobutyl)methanamine

C9H19N — CID 65014589

IUPAC(3-tert-butylcyclobutyl)methanamine
SMILESCC(C)(C)C1CC(CN)C1
InChIInChI=1S/C9H19N/c1-9(2,3)8-4-7(5-8)6-10/h7-8H,4-6,10H2,1-3H3
InChIKeyWQWJQZWVFAJXQF-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.02
Rot. Bonds1

About (3-tert-butylcyclobutyl)methanamine

(3-tert-butylcyclobutyl)methanamine (PubChem CID 65014589) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is (3-tert-butylcyclobutyl)methanamine.

Molecular Properties

Compound Name(3-tert-butylcyclobutyl)methanamine
PubChem CID65014589
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name(3-tert-butylcyclobutyl)methanamine
SMILESCC(C)(C)C1CC(CN)C1
InChIInChI=1S/C9H19N/c1-9(2,3)8-4-7(5-8)6-10/h7-8H,4-6,10H2,1-3H3
InChIKeyWQWJQZWVFAJXQF-UHFFFAOYSA-N
XLogP2.02
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (3-tert-butylcyclobutyl)methanamine 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-tert-butylcyclobutyl)methanamine?
The IUPAC name of (3-tert-butylcyclobutyl)methanamine (CID 65014589) is (3-tert-butylcyclobutyl)methanamine.
What is the SMILES notation for (3-tert-butylcyclobutyl)methanamine?
The canonical SMILES for (3-tert-butylcyclobutyl)methanamine is CC(C)(C)C1CC(CN)C1.
What is the InChIKey of (3-tert-butylcyclobutyl)methanamine?
The InChIKey is WQWJQZWVFAJXQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-9(2,3)8-4-7(5-8)6-10/h7-8H,4-6,10H2,1-3H3.
What are the key properties of (3-tert-butylcyclobutyl)methanamine?
(3-tert-butylcyclobutyl)methanamine has a molecular weight of 141.26 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-tert-butylcyclobutyl)methanamine is sourced from PubChem (CID 65014589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).