2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine

C12H22N2 — CID 130525697

IUPAC2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine
SMILESCN(C1CCC1)C1(CN)CCC2CC21
InChIInChI=1S/C12H22N2/c1-14(10-3-2-4-10)12(8-13)6-5-9-7-11(9)12/h9-11H,2-8,13H2,1H3
InChIKeyRKLFEHFOEYADGL-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.60
Rot. Bonds3

About 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine

2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine (PubChem CID 130525697) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine
PubChem CID130525697
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine
SMILESCN(C1CCC1)C1(CN)CCC2CC21
InChIInChI=1S/C12H22N2/c1-14(10-3-2-4-10)12(8-13)6-5-9-7-11(9)12/h9-11H,2-8,13H2,1H3
InChIKeyRKLFEHFOEYADGL-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine?
The IUPAC name of 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine (CID 130525697) is 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine.
What is the SMILES notation for 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine?
The canonical SMILES for 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine is CN(C1CCC1)C1(CN)CCC2CC21.
What is the InChIKey of 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine?
The InChIKey is RKLFEHFOEYADGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-14(10-3-2-4-10)12(8-13)6-5-9-7-11(9)12/h9-11H,2-8,13H2,1H3.
What are the key properties of 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine?
2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine has a molecular weight of 194.32 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclobutyl-N-methylbicyclo[3.1.0]hexan-2-amine is sourced from PubChem (CID 130525697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).