N-ethenyl-1-methylcyclobutan-1-amine

C7H13N — CID 168948810

IUPACN-ethenyl-1-methylcyclobutan-1-amine
SMILESC=CNC1(C)CCC1
InChIInChI=1S/C7H13N/c1-3-8-7(2)5-4-6-7/h3,8H,1,4-6H2,2H3
InChIKeyOBVWCNOERUPJPD-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.66
Rot. Bonds2

About N-ethenyl-1-methylcyclobutan-1-amine

N-ethenyl-1-methylcyclobutan-1-amine (PubChem CID 168948810) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is N-ethenyl-1-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-ethenyl-1-methylcyclobutan-1-amine
PubChem CID168948810
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC NameN-ethenyl-1-methylcyclobutan-1-amine
SMILESC=CNC1(C)CCC1
InChIInChI=1S/C7H13N/c1-3-8-7(2)5-4-6-7/h3,8H,1,4-6H2,2H3
InChIKeyOBVWCNOERUPJPD-UHFFFAOYSA-N
XLogP1.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-ethenyl-1-methylcyclobutan-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 N-ethenyl-1-methylcyclobutan-1-amine?
The IUPAC name of N-ethenyl-1-methylcyclobutan-1-amine (CID 168948810) is N-ethenyl-1-methylcyclobutan-1-amine.
What is the SMILES notation for N-ethenyl-1-methylcyclobutan-1-amine?
The canonical SMILES for N-ethenyl-1-methylcyclobutan-1-amine is C=CNC1(C)CCC1.
What is the InChIKey of N-ethenyl-1-methylcyclobutan-1-amine?
The InChIKey is OBVWCNOERUPJPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-3-8-7(2)5-4-6-7/h3,8H,1,4-6H2,2H3.
What are the key properties of N-ethenyl-1-methylcyclobutan-1-amine?
N-ethenyl-1-methylcyclobutan-1-amine has a molecular weight of 111.19 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-1-methylcyclobutan-1-amine is sourced from PubChem (CID 168948810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).