2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine

C13H17NO — CID 126619868

IUPAC2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine
SMILESCCc1ccc2cc(CCNC)oc2c1
InChIInChI=1S/C13H17NO/c1-3-10-4-5-11-9-12(6-7-14-2)15-13(11)8-10/h4-5,8-9,14H,3,6-7H2,1-2H3
InChIKeyYOMFVQXDXXTEHP-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.76
Rot. Bonds4

About 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine

2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine (PubChem CID 126619868) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine
PubChem CID126619868
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine
SMILESCCc1ccc2cc(CCNC)oc2c1
InChIInChI=1S/C13H17NO/c1-3-10-4-5-11-9-12(6-7-14-2)15-13(11)8-10/h4-5,8-9,14H,3,6-7H2,1-2H3
InChIKeyYOMFVQXDXXTEHP-UHFFFAOYSA-N
XLogP2.76
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-1-benzofuran-6-yl)-N-methylethanamine
CID 83900820
1-[2-[2-(propan-2-ylamino)ethyl]-1-benzofuran-6-yl]butan-2-one
CID 134414126
2-(2-propyl-1-benzofuran-6-yl)acetic acid
CID 70578535
2-(1-benzofuran-5-yl)-N-methylethanamine
CID 168924293
1-[2-[2-(propan-2-ylamino)ethyl]-1-benzofuran-6-yl]propan-2-one
CID 167181305
2-[2-(methylamino)ethyl]-1-benzofuran-4-ol
CID 117194545
(5-ethyl-1-benzofuran-2-yl)methanol
CID 65439757
N-(1-benzofuran-2-ylmethyl)-2-(4-methoxyphenyl)ethanamine
CID 29276863
7-ethyl-3-propan-2-ylchromen-2-one
CID 176948949
methyl 2-[2-(6-methoxycarbonyl-1-benzofuran-2-yl)ethyl]-1-benzofuran-6-carboxylate
CID 23655159
ethane;N-methyl-2-(4-propylphenyl)ethanamine
CID 143565028
N-[2-(1-benzofuran-2-yl)ethyl]-4-(methylamino)butanamide
CID 119799114

Frequently Asked Questions

What is the IUPAC name of 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine?
The IUPAC name of 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine (CID 126619868) is 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine?
The canonical SMILES for 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine is CCc1ccc2cc(CCNC)oc2c1.
What is the InChIKey of 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine?
The InChIKey is YOMFVQXDXXTEHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-3-10-4-5-11-9-12(6-7-14-2)15-13(11)8-10/h4-5,8-9,14H,3,6-7H2,1-2H3.
What are the key properties of 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine?
2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine has a molecular weight of 203.28 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethyl-1-benzofuran-2-yl)-N-methylethanamine is sourced from PubChem (CID 126619868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).