1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine

C15H17NO2 — CID 43487185

IUPAC1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine
SMILESCNC(c1ccoc1)c1ccc2c(c1)CC(C)O2
InChIInChI=1S/C15H17NO2/c1-10-7-13-8-11(3-4-14(13)18-10)15(16-2)12-5-6-17-9-12/h3-6,8-10,15-16H,7H2,1-2H3
InChIKeyKBZLZUNXGGAGLH-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.91
Rot. Bonds3

About 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine

1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine (PubChem CID 43487185) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine.

Molecular Properties

Compound Name1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine
PubChem CID43487185
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine
SMILESCNC(c1ccoc1)c1ccc2c(c1)CC(C)O2
InChIInChI=1S/C15H17NO2/c1-10-7-13-8-11(3-4-14(13)18-10)15(16-2)12-5-6-17-9-12/h3-6,8-10,15-16H,7H2,1-2H3
InChIKeyKBZLZUNXGGAGLH-UHFFFAOYSA-N
XLogP2.91
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chloro-4-fluorophenyl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine
CID 43487238
6-[furan-3-yl(methylamino)methyl]-3-methyl-1,4-dihydroquinazolin-2-one
CID 82008974
5-[furan-3-yl(methylamino)methyl]-1,3-dihydroindol-2-one
CID 43484758
N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1-(oxan-4-yl)methanamine
CID 55131785
2-ethyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-N-propylbutan-1-amine
CID 43498124
N-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(5-methylfuran-3-yl)methyl]ethanamine
CID 114820033
N-[(4-bromophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methyl]ethanamine
CID 43493498
N-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(5-methylfuran-2-yl)methyl]propan-1-amine
CID 43498090
2-cycloheptyl-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)ethanamine
CID 114457557
N-[(2-bromofuran-3-yl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methyl]ethanamine
CID 106851654
(1R)-1-[(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]propan-1-amine
CID 42129700
1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine
CID 63948375

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine?
The IUPAC name of 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine (CID 43487185) is 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine.
What is the SMILES notation for 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine?
The canonical SMILES for 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine is CNC(c1ccoc1)c1ccc2c(c1)CC(C)O2.
What is the InChIKey of 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine?
The InChIKey is KBZLZUNXGGAGLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-10-7-13-8-11(3-4-14(13)18-10)15(16-2)12-5-6-17-9-12/h3-6,8-10,15-16H,7H2,1-2H3.
What are the key properties of 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine?
1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine has a molecular weight of 243.31 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine is sourced from PubChem (CID 43487185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).