1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine

C17H17NO2 — CID 63091128

IUPAC1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(OC)cc1)c1cc2ccccc2o1
InChIInChI=1S/C17H17NO2/c1-18-17(12-7-9-14(19-2)10-8-12)16-11-13-5-3-4-6-15(13)20-16/h3-11,17-18H,1-2H3
InChIKeyDUCZEIFKOOOCHW-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.75
Rot. Bonds4

About 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine

1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine (PubChem CID 63091128) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine
PubChem CID63091128
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(OC)cc1)c1cc2ccccc2o1
InChIInChI=1S/C17H17NO2/c1-18-17(12-7-9-14(19-2)10-8-12)16-11-13-5-3-4-6-15(13)20-16/h3-11,17-18H,1-2H3
InChIKeyDUCZEIFKOOOCHW-UHFFFAOYSA-N
XLogP3.75
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(R)-1-benzofuran-2-yl-(4-methoxyphenyl)methyl]-4-methylbenzenesulfonamide
CID 134953908
1-(7-chloro-1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 114727492
1-(1-benzofuran-2-yl)-N-methyl-1-(4-propylphenyl)methanamine
CID 63089906
1-(1-benzofuran-2-yl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 63089905
1-(1-benzofuran-2-yl)-1-(2,5-dimethylfuran-3-yl)-N-methylmethanamine
CID 105044001
N-[1-benzofuran-2-yl(phenyl)methyl]-2,4-dimethoxybenzamide
CID 43035801
N-methyl-1-(5-methyl-1-benzofuran-2-yl)-1-phenylmethanamine
CID 114727848
1-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 43481665
1-(1-benzofuran-2-yl)-3-(4-methoxyphenyl)propan-1-ol
CID 65447175
1-(1-benzofuran-2-yl)-1-(3-chloro-2-methylphenyl)-N-methylmethanamine
CID 107103108
2-[1-bromo-2-(4-methoxyphenyl)ethyl]-1-benzofuran
CID 63542413
N-[1-(1-benzofuran-2-yl)ethyl]-2,5-dimethoxyaniline
CID 43824329

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine (CID 63091128) is 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine is CNC(c1ccc(OC)cc1)c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The InChIKey is DUCZEIFKOOOCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-18-17(12-7-9-14(19-2)10-8-12)16-11-13-5-3-4-6-15(13)20-16/h3-11,17-18H,1-2H3.
What are the key properties of 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine?
1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine has a molecular weight of 267.33 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-1-(4-methoxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 63091128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).