1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine

C12H14BrNO2 — CID 106851788

IUPAC1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
SMILESCCc1ccc(C(NC)c2ccoc2Br)o1
InChIInChI=1S/C12H14BrNO2/c1-3-8-4-5-10(16-8)11(14-2)9-6-7-15-12(9)13/h4-7,11,14H,3H2,1-2H3
InChIKeyKRKMQACSNWYFHD-UHFFFAOYSA-N
MW284.15 g/mol
LogP3.51
Rot. Bonds4

About 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine

1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine (PubChem CID 106851788) has the molecular formula C12H14BrNO2 and a molecular weight of 284.15 g/mol. Its IUPAC name is 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
PubChem CID106851788
Molecular FormulaC12H14BrNO2
Molecular Weight284.15 g/mol
Exact Mass283.02
IUPAC Name1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
SMILESCCc1ccc(C(NC)c2ccoc2Br)o1
InChIInChI=1S/C12H14BrNO2/c1-3-8-4-5-10(16-8)11(14-2)9-6-7-15-12(9)13/h4-7,11,14H,3H2,1-2H3
InChIKeyKRKMQACSNWYFHD-UHFFFAOYSA-N
XLogP3.51
TPSA38.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.15
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-bromo-2,5-dimethoxyphenyl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 105056762
1-(5-bromothiophen-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 107960959
1-(4-chloro-2,5-dimethylphenyl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 79094310
1-(5-ethylfuran-2-yl)-1-(5-fluoro-2-methylphenyl)-N-methylmethanamine
CID 63048430
1-(2-bromofuran-3-yl)-1-(furan-3-yl)-N-methylmethanamine
CID 106857587
N-[(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methyl]propan-1-amine
CID 115861459
1-(5-chloro-2-methoxyphenyl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 62346399
1-(5-ethylfuran-2-yl)-N-methyl-1-thiophen-2-ylmethanamine
CID 62344802
1-(2-bromofuran-3-yl)-N-methyl-1-(4-phenylphenyl)methanamine
CID 106851546
1-(5-ethylfuran-2-yl)-N-methyl-1-thiophen-3-ylmethanamine
CID 62345338
1-(2-bromo-4,5-dimethoxyphenyl)-1-(2-bromofuran-3-yl)-N-methylmethanamine
CID 106851573
(1S)-1-(5-ethylfuran-2-yl)-N-methylethanamine
CID 94399040

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine (CID 106851788) is 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine is CCc1ccc(C(NC)c2ccoc2Br)o1.
What is the InChIKey of 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine?
The InChIKey is KRKMQACSNWYFHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrNO2/c1-3-8-4-5-10(16-8)11(14-2)9-6-7-15-12(9)13/h4-7,11,14H,3H2,1-2H3.
What are the key properties of 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine?
1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine has a molecular weight of 284.15 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromofuran-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine is sourced from PubChem (CID 106851788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).