2-ethyl-5-methyl-1-benzofuran-3-amine

C11H13NO — CID 82372673

IUPAC2-ethyl-5-methyl-1-benzofuran-3-amine
SMILESCCc1oc2ccc(C)cc2c1N
InChIInChI=1S/C11H13NO/c1-3-9-11(12)8-6-7(2)4-5-10(8)13-9/h4-6H,3,12H2,1-2H3
InChIKeyLRZWTRSZIXKQKQ-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.89
Rot. Bonds1

About 2-ethyl-5-methyl-1-benzofuran-3-amine

2-ethyl-5-methyl-1-benzofuran-3-amine (PubChem CID 82372673) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 2-ethyl-5-methyl-1-benzofuran-3-amine.

Molecular Properties

Compound Name2-ethyl-5-methyl-1-benzofuran-3-amine
PubChem CID82372673
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name2-ethyl-5-methyl-1-benzofuran-3-amine
SMILESCCc1oc2ccc(C)cc2c1N
InChIInChI=1S/C11H13NO/c1-3-9-11(12)8-6-7(2)4-5-10(8)13-9/h4-6H,3,12H2,1-2H3
InChIKeyLRZWTRSZIXKQKQ-UHFFFAOYSA-N
XLogP2.89
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[C-(2-ethyl-5-methyl-1-benzofuran-3-yl)-N-hydroxycarbonimidoyl]-2,6-diiodophenol
CID 170600580
2-ethyl-3-[(E)-2-[(4-methoxyphenyl)methyl]but-1-enyl]-5-methyl-1-benzofuran
CID 142970496
ethyl 3-ethyl-5-methyl-1-benzofuran-2-carboxylate
CID 138539367
CID 158430443
CID 158430443
carbanide;6,18-diethyl-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4(9),5,7,11,15(20),16,18-nonaene;7,16-diethyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;ethane;6-ethyl-18-methyl-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15(20),16,18-nonaene;7-ethyl-16-methyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;hexadecakis(yttrium)
CID 161346794
ethyl 2-[3-[(R)-ethylsulfinyl]-5-methyl-1-benzofuran-2-yl]acetate
CID 139076357
3-chloro-2,5-dimethyl-1-benzofuran
CID 90163019
2-iodo-3,5-dimethyl-1-benzofuran
CID 163624789
N-[(Z)-(2-ethyl-1-benzofuran-3-yl)methylideneamino]-4-methylaniline
CID 8825966
7-amino-8-hydroxy-2-methylbenzo[c]chromen-6-one
CID 14631583
actinium;8-methyldibenzofuran-2-ol
CID 18739071
2-(5-methyl-3-methylsulfinyl-1-benzofuran-2-yl)acetic acid
CID 91513407

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-1-benzofuran-3-amine?
The IUPAC name of 2-ethyl-5-methyl-1-benzofuran-3-amine (CID 82372673) is 2-ethyl-5-methyl-1-benzofuran-3-amine.
What is the SMILES notation for 2-ethyl-5-methyl-1-benzofuran-3-amine?
The canonical SMILES for 2-ethyl-5-methyl-1-benzofuran-3-amine is CCc1oc2ccc(C)cc2c1N.
What is the InChIKey of 2-ethyl-5-methyl-1-benzofuran-3-amine?
The InChIKey is LRZWTRSZIXKQKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-3-9-11(12)8-6-7(2)4-5-10(8)13-9/h4-6H,3,12H2,1-2H3.
What are the key properties of 2-ethyl-5-methyl-1-benzofuran-3-amine?
2-ethyl-5-methyl-1-benzofuran-3-amine has a molecular weight of 175.23 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-1-benzofuran-3-amine is sourced from PubChem (CID 82372673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).