(2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine

C15H23NO — CID 165457148

IUPAC(2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine
SMILESNCc1cc(C2CCCCC2)oc1C1CCC1
InChIInChI=1S/C15H23NO/c16-10-13-9-14(11-5-2-1-3-6-11)17-15(13)12-7-4-8-12/h9,11-12H,1-8,10,16H2
InChIKeyFHDFAVVVQKPBDA-UHFFFAOYSA-N
MW233.35 g/mol
LogP4.05
Rot. Bonds3

About (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine

(2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine (PubChem CID 165457148) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine.

Molecular Properties

Compound Name(2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine
PubChem CID165457148
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name(2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine
SMILESNCc1cc(C2CCCCC2)oc1C1CCC1
InChIInChI=1S/C15H23NO/c16-10-13-9-14(11-5-2-1-3-6-11)17-15(13)12-7-4-8-12/h9,11-12H,1-8,10,16H2
InChIKeyFHDFAVVVQKPBDA-UHFFFAOYSA-N
XLogP4.05
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine?
The IUPAC name of (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine (CID 165457148) is (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine.
What is the SMILES notation for (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine?
The canonical SMILES for (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine is NCc1cc(C2CCCCC2)oc1C1CCC1.
What is the InChIKey of (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine?
The InChIKey is FHDFAVVVQKPBDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c16-10-13-9-14(11-5-2-1-3-6-11)17-15(13)12-7-4-8-12/h9,11-12H,1-8,10,16H2.
What are the key properties of (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine?
(2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine has a molecular weight of 233.35 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclobutyl-5-cyclohexylfuran-3-yl)methanamine is sourced from PubChem (CID 165457148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).