1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine

C12H21NO — CID 102651300

IUPAC1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
SMILESCNC(C1=CCCO1)C1CCCCC1
InChIInChI=1S/C12H21NO/c1-13-12(11-8-5-9-14-11)10-6-3-2-4-7-10/h8,10,12-13H,2-7,9H2,1H3
InChIKeyJLWZJXSISDFMBA-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.46
Rot. Bonds3

About 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine

1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine (PubChem CID 102651300) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
PubChem CID102651300
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
SMILESCNC(C1=CCCO1)C1CCCCC1
InChIInChI=1S/C12H21NO/c1-13-12(11-8-5-9-14-11)10-6-3-2-4-7-10/h8,10,12-13H,2-7,9H2,1H3
InChIKeyJLWZJXSISDFMBA-UHFFFAOYSA-N
XLogP2.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine?
The IUPAC name of 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine (CID 102651300) is 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine is CNC(C1=CCCO1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine?
The InChIKey is JLWZJXSISDFMBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-13-12(11-8-5-9-14-11)10-6-3-2-4-7-10/h8,10,12-13H,2-7,9H2,1H3.
What are the key properties of 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine?
1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine has a molecular weight of 195.31 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine is sourced from PubChem (CID 102651300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).