furan-3-yl-(4-methylcyclohexyl)methanamine

C12H19NO — CID 63948782

IUPACfuran-3-yl-(4-methylcyclohexyl)methanamine
SMILESCC1CCC(C(N)c2ccoc2)CC1
InChIInChI=1S/C12H19NO/c1-9-2-4-10(5-3-9)12(13)11-6-7-14-8-11/h6-10,12H,2-5,13H2,1H3
InChIKeyOWUFUOFIBBKTBF-UHFFFAOYSA-N
MW193.29 g/mol
LogP3.11
Rot. Bonds2

About furan-3-yl-(4-methylcyclohexyl)methanamine

furan-3-yl-(4-methylcyclohexyl)methanamine (PubChem CID 63948782) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is furan-3-yl-(4-methylcyclohexyl)methanamine.

Molecular Properties

Compound Namefuran-3-yl-(4-methylcyclohexyl)methanamine
PubChem CID63948782
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Namefuran-3-yl-(4-methylcyclohexyl)methanamine
SMILESCC1CCC(C(N)c2ccoc2)CC1
InChIInChI=1S/C12H19NO/c1-9-2-4-10(5-3-9)12(13)11-6-7-14-8-11/h6-10,12H,2-5,13H2,1H3
InChIKeyOWUFUOFIBBKTBF-UHFFFAOYSA-N
XLogP3.11
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of furan-3-yl-(4-methylcyclohexyl)methanamine?
The IUPAC name of furan-3-yl-(4-methylcyclohexyl)methanamine (CID 63948782) is furan-3-yl-(4-methylcyclohexyl)methanamine.
What is the SMILES notation for furan-3-yl-(4-methylcyclohexyl)methanamine?
The canonical SMILES for furan-3-yl-(4-methylcyclohexyl)methanamine is CC1CCC(C(N)c2ccoc2)CC1.
What is the InChIKey of furan-3-yl-(4-methylcyclohexyl)methanamine?
The InChIKey is OWUFUOFIBBKTBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-9-2-4-10(5-3-9)12(13)11-6-7-14-8-11/h6-10,12H,2-5,13H2,1H3.
What are the key properties of furan-3-yl-(4-methylcyclohexyl)methanamine?
furan-3-yl-(4-methylcyclohexyl)methanamine has a molecular weight of 193.29 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-(4-methylcyclohexyl)methanamine is sourced from PubChem (CID 63948782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).