1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine

C12H24N2 — CID 116958914

IUPAC1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine
SMILESCNCC1(C(NC)C2CCC2)CCC1
InChIInChI=1S/C12H24N2/c1-13-9-12(7-4-8-12)11(14-2)10-5-3-6-10/h10-11,13-14H,3-9H2,1-2H3
InChIKeyPATZGUSLBGTCLK-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.76
Rot. Bonds5

About 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine

1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine (PubChem CID 116958914) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine
PubChem CID116958914
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine
SMILESCNCC1(C(NC)C2CCC2)CCC1
InChIInChI=1S/C12H24N2/c1-13-9-12(7-4-8-12)11(14-2)10-5-3-6-10/h10-11,13-14H,3-9H2,1-2H3
InChIKeyPATZGUSLBGTCLK-UHFFFAOYSA-N
XLogP1.76
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine?
The IUPAC name of 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine (CID 116958914) is 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine.
What is the SMILES notation for 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine?
The canonical SMILES for 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine is CNCC1(C(NC)C2CCC2)CCC1.
What is the InChIKey of 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine?
The InChIKey is PATZGUSLBGTCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-13-9-12(7-4-8-12)11(14-2)10-5-3-6-10/h10-11,13-14H,3-9H2,1-2H3.
What are the key properties of 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine?
1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine has a molecular weight of 196.34 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-methyl-1-[1-(methylaminomethyl)cyclobutyl]methanamine is sourced from PubChem (CID 116958914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).