2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline

C14H17NO — CID 63204552

IUPAC2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline
SMILESCCc1cccc(C)c1NCc1ccoc1
InChIInChI=1S/C14H17NO/c1-3-13-6-4-5-11(2)14(13)15-9-12-7-8-16-10-12/h4-8,10,15H,3,9H2,1-2H3
InChIKeyLUTSOXFSWWPBOH-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.76
Rot. Bonds4

About 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline

2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline (PubChem CID 63204552) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline.

Molecular Properties

Compound Name2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline
PubChem CID63204552
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline
SMILESCCc1cccc(C)c1NCc1ccoc1
InChIInChI=1S/C14H17NO/c1-3-13-6-4-5-11(2)14(13)15-9-12-7-8-16-10-12/h4-8,10,15H,3,9H2,1-2H3
InChIKeyLUTSOXFSWWPBOH-UHFFFAOYSA-N
XLogP3.76
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(furan-3-ylmethyl)-2,6-dimethylaniline
CID 115749450
N-[(4-chlorophenyl)methyl]-2-ethyl-6-methylaniline
CID 54798399
2-ethyl-6-methyl-N-(1H-pyrrol-3-ylmethyl)aniline
CID 66409186
2-ethyl-N-[(3-fluoro-4-methylphenyl)methyl]-6-methylaniline
CID 63646546
N-[(2,6-dichlorophenyl)methyl]-2-ethyl-6-methylaniline
CID 63448215
2,6-dichloro-N-(furan-3-ylmethyl)aniline
CID 65468765
2-ethyl-6-methyl-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]aniline
CID 62475131
2-ethyl-N-[(5-iodofuran-2-yl)methyl]-6-methylaniline
CID 54862209
2,6-diethyl-N-[(4-methylphenyl)methyl]aniline
CID 63492108
N-[(3,4-dimethylphenyl)methyl]-2,6-diethylaniline
CID 63490881
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-ethyl-6-methylaniline
CID 83092684
methyl 3-[(2-ethyl-6-methylanilino)methyl]furan-2-carboxylate
CID 60924016

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline?
The IUPAC name of 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline (CID 63204552) is 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline.
What is the SMILES notation for 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline?
The canonical SMILES for 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline is CCc1cccc(C)c1NCc1ccoc1.
What is the InChIKey of 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline?
The InChIKey is LUTSOXFSWWPBOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-3-13-6-4-5-11(2)14(13)15-9-12-7-8-16-10-12/h4-8,10,15H,3,9H2,1-2H3.
What are the key properties of 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline?
2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline has a molecular weight of 215.30 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(furan-3-ylmethyl)-6-methylaniline is sourced from PubChem (CID 63204552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).