2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine

C10H14BrNO — CID 131020719

IUPAC2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine
SMILESCC1(C(N)Cc2ccc(Br)o2)CC1
InChIInChI=1S/C10H14BrNO/c1-10(4-5-10)8(12)6-7-2-3-9(11)13-7/h2-3,8H,4-6,12H2,1H3
InChIKeyGJSZLPWNVIFJRD-UHFFFAOYSA-N
MW244.13 g/mol
LogP2.71
Rot. Bonds3

About 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine

2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine (PubChem CID 131020719) has the molecular formula C10H14BrNO and a molecular weight of 244.13 g/mol. Its IUPAC name is 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine.

Molecular Properties

Compound Name2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine
PubChem CID131020719
Molecular FormulaC10H14BrNO
Molecular Weight244.13 g/mol
Exact Mass243.03
IUPAC Name2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine
SMILESCC1(C(N)Cc2ccc(Br)o2)CC1
InChIInChI=1S/C10H14BrNO/c1-10(4-5-10)8(12)6-7-2-3-9(11)13-7/h2-3,8H,4-6,12H2,1H3
InChIKeyGJSZLPWNVIFJRD-UHFFFAOYSA-N
XLogP2.71
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.13
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine?
The IUPAC name of 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine (CID 131020719) is 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine.
What is the SMILES notation for 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine?
The canonical SMILES for 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine is CC1(C(N)Cc2ccc(Br)o2)CC1.
What is the InChIKey of 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine?
The InChIKey is GJSZLPWNVIFJRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNO/c1-10(4-5-10)8(12)6-7-2-3-9(11)13-7/h2-3,8H,4-6,12H2,1H3.
What are the key properties of 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine?
2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine has a molecular weight of 244.13 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromofuran-2-yl)-1-(1-methylcyclopropyl)ethanamine is sourced from PubChem (CID 131020719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).