2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine

C12H19NO — CID 83907612

IUPAC2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine
SMILESCCc1cc2c(o1)C(CCN)CCC2
InChIInChI=1S/C12H19NO/c1-2-11-8-10-5-3-4-9(6-7-13)12(10)14-11/h8-9H,2-7,13H2,1H3
InChIKeyNFDXXTXYZNTGND-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.61
Rot. Bonds3

About 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine

2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine (PubChem CID 83907612) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine.

Molecular Properties

Compound Name2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine
PubChem CID83907612
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine
SMILESCCc1cc2c(o1)C(CCN)CCC2
InChIInChI=1S/C12H19NO/c1-2-11-8-10-5-3-4-9(6-7-13)12(10)14-11/h8-9H,2-7,13H2,1H3
InChIKeyNFDXXTXYZNTGND-UHFFFAOYSA-N
XLogP2.61
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)propan-1-amine
CID 112716078
2-(4,5,6,7-tetrahydro-1,2-benzoxazol-7-yl)ethanamine
CID 83873526
2-[(1R)-7-ethyl-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamine
CID 67627169
2-(7-ethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 15816636
N-methyl-1-(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)methanamine
CID 83906347
1-(2-chloro-4,5,6,7-tetrahydro-1-benzofuran-7-yl)-N-methylmethanamine
CID 83908304
2-(2-propan-2-yl-4,5,6,7-tetrahydro-1-benzofuran-4-yl)ethanamine
CID 83909092
2-(6,8-difluoro-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 84781691
2-[7-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamine
CID 82542874
2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 83829383
2-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine
CID 83907867
2-(5-ethyl-2,3-dihydro-1-benzofuran-3-yl)ethanamine
CID 21460973

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine?
The IUPAC name of 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine (CID 83907612) is 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine.
What is the SMILES notation for 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine?
The canonical SMILES for 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine is CCc1cc2c(o1)C(CCN)CCC2.
What is the InChIKey of 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine?
The InChIKey is NFDXXTXYZNTGND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-2-11-8-10-5-3-4-9(6-7-13)12(10)14-11/h8-9H,2-7,13H2,1H3.
What are the key properties of 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine?
2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-4,5,6,7-tetrahydro-1-benzofuran-7-yl)ethanamine is sourced from PubChem (CID 83907612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).