1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine

C14H17NO — CID 105468832

IUPAC1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine
SMILESCc1cc2cccc(CCC3(N)CC3)c2o1
InChIInChI=1S/C14H17NO/c1-10-9-12-4-2-3-11(13(12)16-10)5-6-14(15)7-8-14/h2-4,9H,5-8,15H2,1H3
InChIKeyXSFQDKHCXYYZLG-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.17
Rot. Bonds3

About 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine

1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine (PubChem CID 105468832) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine
PubChem CID105468832
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine
SMILESCc1cc2cccc(CCC3(N)CC3)c2o1
InChIInChI=1S/C14H17NO/c1-10-9-12-4-2-3-11(13(12)16-10)5-6-14(15)7-8-14/h2-4,9H,5-8,15H2,1H3
InChIKeyXSFQDKHCXYYZLG-UHFFFAOYSA-N
XLogP3.17
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine (CID 105468832) is 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine is Cc1cc2cccc(CCC3(N)CC3)c2o1.
What is the InChIKey of 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine?
The InChIKey is XSFQDKHCXYYZLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-10-9-12-4-2-3-11(13(12)16-10)5-6-14(15)7-8-14/h2-4,9H,5-8,15H2,1H3.
What are the key properties of 1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine?
1-[2-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine has a molecular weight of 215.30 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-(2-methyl-1-benzofuran-7-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105468832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).