1-(1-methylcyclobutyl)ethanamine

C7H15N — CID 139582054

IUPAC1-(1-methylcyclobutyl)ethanamine
SMILESCC(N)C1(C)CCC1
InChIInChI=1S/C7H15N/c1-6(8)7(2)4-3-5-7/h6H,3-5,8H2,1-2H3
InChIKeyCSAVHZDLFZCPIU-UHFFFAOYSA-N
MW113.20 g/mol
LogP1.52
Rot. Bonds1

About 1-(1-methylcyclobutyl)ethanamine

1-(1-methylcyclobutyl)ethanamine (PubChem CID 139582054) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is 1-(1-methylcyclobutyl)ethanamine.

Molecular Properties

Compound Name1-(1-methylcyclobutyl)ethanamine
PubChem CID139582054
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Name1-(1-methylcyclobutyl)ethanamine
SMILESCC(N)C1(C)CCC1
InChIInChI=1S/C7H15N/c1-6(8)7(2)4-3-5-7/h6H,3-5,8H2,1-2H3
InChIKeyCSAVHZDLFZCPIU-UHFFFAOYSA-N
XLogP1.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclobutyl)ethanamine?
The IUPAC name of 1-(1-methylcyclobutyl)ethanamine (CID 139582054) is 1-(1-methylcyclobutyl)ethanamine.
What is the SMILES notation for 1-(1-methylcyclobutyl)ethanamine?
The canonical SMILES for 1-(1-methylcyclobutyl)ethanamine is CC(N)C1(C)CCC1.
What is the InChIKey of 1-(1-methylcyclobutyl)ethanamine?
The InChIKey is CSAVHZDLFZCPIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N/c1-6(8)7(2)4-3-5-7/h6H,3-5,8H2,1-2H3.
What are the key properties of 1-(1-methylcyclobutyl)ethanamine?
1-(1-methylcyclobutyl)ethanamine has a molecular weight of 113.20 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclobutyl)ethanamine is sourced from PubChem (CID 139582054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).