1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine

C15H16BrNO — CID 106892781

IUPAC1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
SMILESCNC(c1ccc(Br)o1)C1Cc2ccccc2C1
InChIInChI=1S/C15H16BrNO/c1-17-15(13-6-7-14(16)18-13)12-8-10-4-2-3-5-11(10)9-12/h2-7,12,15,17H,8-9H2,1H3
InChIKeyXXHJKBBWKHQPIK-UHFFFAOYSA-N
MW306.20 g/mol
LogP3.72
Rot. Bonds3

About 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine

1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine (PubChem CID 106892781) has the molecular formula C15H16BrNO and a molecular weight of 306.20 g/mol. Its IUPAC name is 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
PubChem CID106892781
Molecular FormulaC15H16BrNO
Molecular Weight306.20 g/mol
Exact Mass305.04
IUPAC Name1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
SMILESCNC(c1ccc(Br)o1)C1Cc2ccccc2C1
InChIInChI=1S/C15H16BrNO/c1-17-15(13-6-7-14(16)18-13)12-8-10-4-2-3-5-11(10)9-12/h2-7,12,15,17H,8-9H2,1H3
InChIKeyXXHJKBBWKHQPIK-UHFFFAOYSA-N
XLogP3.72
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.20
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(5-bromofuran-2-yl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methyl]ethanamine
CID 107126566
1-(4-bromo-2,5-dimethylphenyl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
CID 106892754
1-(2,3-dihydro-1H-inden-2-yl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 65410726
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 65412087
1-(2,4-difluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
CID 65411306
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine
CID 65410729
1-(2,3-dihydro-1H-inden-2-yl)-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 65410721
1-(2-chloro-4,5-difluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
CID 107476284
1-(2,3-dihydro-1H-inden-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
CID 106892701
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 65409933
1-(2,3-dihydro-1H-inden-2-yl)-1-(3-fluoro-5-methylphenyl)-N-methylmethanamine
CID 79703756
1-(5-bromofuran-2-yl)-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)ethanamine
CID 104652832

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine (CID 106892781) is 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine is CNC(c1ccc(Br)o1)C1Cc2ccccc2C1.
What is the InChIKey of 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine?
The InChIKey is XXHJKBBWKHQPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrNO/c1-17-15(13-6-7-14(16)18-13)12-8-10-4-2-3-5-11(10)9-12/h2-7,12,15,17H,8-9H2,1H3.
What are the key properties of 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine?
1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine has a molecular weight of 306.20 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromofuran-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine is sourced from PubChem (CID 106892781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).