cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine

C15H21NO — CID 114744914

IUPACcyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine
SMILESNC(c1cccc2c1OCC2)C1CCCCC1
InChIInChI=1S/C15H21NO/c16-14(11-5-2-1-3-6-11)13-8-4-7-12-9-10-17-15(12)13/h4,7-8,11,14H,1-3,5-6,9-10,16H2
InChIKeySNHHCTUDGRJAJK-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.20
Rot. Bonds2

About cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine

cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine (PubChem CID 114744914) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine.

Molecular Properties

Compound Namecyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine
PubChem CID114744914
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Namecyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine
SMILESNC(c1cccc2c1OCC2)C1CCCCC1
InChIInChI=1S/C15H21NO/c16-14(11-5-2-1-3-6-11)13-8-4-7-12-9-10-17-15(12)13/h4,7-8,11,14H,1-3,5-6,9-10,16H2
InChIKeySNHHCTUDGRJAJK-UHFFFAOYSA-N
XLogP3.20
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cycloheptyl(3,4-dihydro-2H-chromen-8-yl)methanamine
CID 114745566
2,3-dihydro-1-benzofuran-7-yl-(3-methylcyclohexyl)methanamine
CID 114745190
[cycloheptyl(2,3-dihydro-1-benzofuran-7-yl)methyl]hydrazine
CID 105232138
[cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methyl]hydrazine
CID 105201988
cyclohexyl(2,3-dihydro-1,4-benzodioxin-5-yl)methanamine
CID 105079651
3,4-dihydro-2H-chromen-8-yl-(4,4-dimethylcyclohexyl)methanamine
CID 114745561
2,3-dihydro-1-benzofuran-7-yl-(1,1-dioxothiolan-3-yl)methanamine
CID 114745990
[2-cycloheptyl-1-(2,3-dihydro-1-benzofuran-7-yl)ethyl]hydrazine
CID 105341787
[cyclohexyl(3,4-dihydro-2H-chromen-8-yl)methyl]hydrazine
CID 105201959
2-cyclopentylsulfanyl-1-(2,3-dihydro-1-benzofuran-7-yl)ethanamine
CID 114745488
N-[cycloheptyl(2,3-dihydro-1-benzofuran-7-yl)methyl]propan-1-amine
CID 114745571
[2,3-dihydro-1-benzofuran-7-yl(oxan-3-yl)methyl]hydrazine
CID 105230130

Frequently Asked Questions

What is the IUPAC name of cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine?
The IUPAC name of cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine (CID 114744914) is cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine.
What is the SMILES notation for cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine?
The canonical SMILES for cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine is NC(c1cccc2c1OCC2)C1CCCCC1.
What is the InChIKey of cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine?
The InChIKey is SNHHCTUDGRJAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c16-14(11-5-2-1-3-6-11)13-8-4-7-12-9-10-17-15(12)13/h4,7-8,11,14H,1-3,5-6,9-10,16H2.
What are the key properties of cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine?
cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine has a molecular weight of 231.34 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl(2,3-dihydro-1-benzofuran-7-yl)methanamine is sourced from PubChem (CID 114744914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).