N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine

C18H19NO — CID 114732283

IUPACN-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine
SMILESCNC(C)c1ccc(-c2cc3cccc(C)c3o2)cc1
InChIInChI=1S/C18H19NO/c1-12-5-4-6-16-11-17(20-18(12)16)15-9-7-14(8-10-15)13(2)19-3/h4-11,13,19H,1-3H3
InChIKeySIJVSJZLHMCBOR-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.69
Rot. Bonds3

About N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine

N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine (PubChem CID 114732283) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine
PubChem CID114732283
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC NameN-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine
SMILESCNC(C)c1ccc(-c2cc3cccc(C)c3o2)cc1
InChIInChI=1S/C18H19NO/c1-12-5-4-6-16-11-17(20-18(12)16)15-9-7-14(8-10-15)13(2)19-3/h4-11,13,19H,1-3H3
InChIKeySIJVSJZLHMCBOR-UHFFFAOYSA-N
XLogP4.69
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-fluoro-3-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine
CID 114732293
1-(4-iodophenyl)-N-methyl-1-(7-methyl-1-benzofuran-2-yl)methanamine
CID 105045524
1-[4-(furan-2-yl)phenyl]-N-methylethanamine
CID 63949148
N-[[5-(7-methyl-1-benzofuran-2-yl)furan-2-yl]methyl]propan-2-amine
CID 106888159
N-methyl-1-[3-(5-methyl-1-benzofuran-2-yl)phenyl]ethanamine
CID 114732246
N-[(1S)-1-(4-methoxyphenyl)ethyl]-7-methyl-1-benzofuran-2-carboxamide
CID 100795374
1-[4-(3-chloro-4-methylphenyl)phenyl]-N-methylethanamine
CID 115504108
N-[1-[4-(1-benzofuran-2-yl)phenyl]ethyl]propan-1-amine
CID 114732147
N-methyl-1-(7-methyl-1-benzofuran-2-yl)-1-(2-methyl-4-pyridinyl)methanamine
CID 106755900
N,5-dimethyl-6-(7-methyl-1-benzofuran-2-yl)pyrimidin-4-amine
CID 114734639
N-methyl-1-(7-methyl-1-benzofuran-2-yl)-2-(2-methylpropylsulfanyl)ethanamine
CID 114728964
N-[(1S)-1-(4-methoxyphenyl)ethyl]-8-methyl-2-oxochromene-3-carboxamide
CID 100794315

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine?
The IUPAC name of N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine (CID 114732283) is N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine.
What is the SMILES notation for N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine?
The canonical SMILES for N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine is CNC(C)c1ccc(-c2cc3cccc(C)c3o2)cc1.
What is the InChIKey of N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine?
The InChIKey is SIJVSJZLHMCBOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-12-5-4-6-16-11-17(20-18(12)16)15-9-7-14(8-10-15)13(2)19-3/h4-11,13,19H,1-3H3.
What are the key properties of N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine?
N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine has a molecular weight of 265.36 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[4-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine is sourced from PubChem (CID 114732283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).