1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine

C17H19NO — CID 114745152

IUPAC1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1CC(N)c1cccc2c1OCC2
InChIInChI=1S/C17H19NO/c1-12-5-2-3-6-14(12)11-16(18)15-8-4-7-13-9-10-19-17(13)15/h2-8,16H,9-11,18H2,1H3
InChIKeyHSKNVMRPYFMEJN-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.17
Rot. Bonds3

About 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine

1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine (PubChem CID 114745152) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine
PubChem CID114745152
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1CC(N)c1cccc2c1OCC2
InChIInChI=1S/C17H19NO/c1-12-5-2-3-6-14(12)11-16(18)15-8-4-7-13-9-10-19-17(13)15/h2-8,16H,9-11,18H2,1H3
InChIKeyHSKNVMRPYFMEJN-UHFFFAOYSA-N
XLogP3.17
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105208501
1-(2,3-dihydro-1-benzofuran-7-yl)-2-(3-methylphenyl)ethanamine
CID 114745163
1-(2,3-dihydro-1-benzofuran-7-yl)-2-(3-fluorophenyl)ethanamine
CID 114745088
1-(2,3-dihydro-1-benzofuran-7-yl)-3,3-dimethylbutan-1-amine
CID 114745358
2-(5-chloro-2,3-dihydro-1-benzofuran-7-yl)-1-(2-chloro-3-methylphenyl)ethanamine
CID 105031480
2-(5-chloro-2,3-dihydro-1-benzofuran-7-yl)-1-(2,3-dimethylphenyl)ethanamine
CID 105031528
1-(2,3-dihydro-1-benzofuran-7-yl)-2-propan-2-yloxyethanamine
CID 105189364
1-(2,3-dihydro-1-benzofuran-7-yl)-N',N'-dimethylpropane-1,3-diamine
CID 114745997
1-(2,3-dihydro-1-benzofuran-7-yl)-2-methylsulfonylethanamine
CID 105053313
1-(2,3-dihydro-1-benzofuran-7-yl)-2-(oxolan-2-yl)ethanamine
CID 114744900
1-(3,4-dihydro-2H-chromen-8-yl)-3-methylbutan-1-amine
CID 114744902
1-(2,3-dihydro-1-benzofuran-7-yl)-N',N'-diethylpropane-1,3-diamine
CID 114745726

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine (CID 114745152) is 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine is Cc1ccccc1CC(N)c1cccc2c1OCC2.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine?
The InChIKey is HSKNVMRPYFMEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-12-5-2-3-6-14(12)11-16(18)15-8-4-7-13-9-10-19-17(13)15/h2-8,16H,9-11,18H2,1H3.
What are the key properties of 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine?
1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine has a molecular weight of 253.35 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzofuran-7-yl)-2-(2-methylphenyl)ethanamine is sourced from PubChem (CID 114745152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).