cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine

C12H23N — CID 105049515

IUPACcyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCC1(C)C(C(N)C2CCC2)C1(C)C
InChIInChI=1S/C12H23N/c1-11(2)10(12(11,3)4)9(13)8-6-5-7-8/h8-10H,5-7,13H2,1-4H3
InChIKeyFFKQWGUZHSWCRP-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.80
Rot. Bonds2

About cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine

cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine (PubChem CID 105049515) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine.

Molecular Properties

Compound Namecyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine
PubChem CID105049515
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Namecyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCC1(C)C(C(N)C2CCC2)C1(C)C
InChIInChI=1S/C12H23N/c1-11(2)10(12(11,3)4)9(13)8-6-5-7-8/h8-10H,5-7,13H2,1-4H3
InChIKeyFFKQWGUZHSWCRP-UHFFFAOYSA-N
XLogP2.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The IUPAC name of cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine (CID 105049515) is cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine.
What is the SMILES notation for cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The canonical SMILES for cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine is CC1(C)C(C(N)C2CCC2)C1(C)C.
What is the InChIKey of cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The InChIKey is FFKQWGUZHSWCRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-11(2)10(12(11,3)4)9(13)8-6-5-7-8/h8-10H,5-7,13H2,1-4H3.
What are the key properties of cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine?
cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine has a molecular weight of 181.32 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(2,2,3,3-tetramethylcyclopropyl)methanamine is sourced from PubChem (CID 105049515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).