1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine

C11H17BrN2O2 — CID 115314919

IUPAC1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine
SMILESCC(N)C1CN(Cc2ccc(Br)o2)CCO1
InChIInChI=1S/C11H17BrN2O2/c1-8(13)10-7-14(4-5-15-10)6-9-2-3-11(12)16-9/h2-3,8,10H,4-7,13H2,1H3
InChIKeyJQZHQEWDKUVZPI-UHFFFAOYSA-N
MW289.17 g/mol
LogP1.59
Rot. Bonds3

About 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine

1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine (PubChem CID 115314919) has the molecular formula C11H17BrN2O2 and a molecular weight of 289.17 g/mol. Its IUPAC name is 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine
PubChem CID115314919
Molecular FormulaC11H17BrN2O2
Molecular Weight289.17 g/mol
Exact Mass288.05
IUPAC Name1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine
SMILESCC(N)C1CN(Cc2ccc(Br)o2)CCO1
InChIInChI=1S/C11H17BrN2O2/c1-8(13)10-7-14(4-5-15-10)6-9-2-3-11(12)16-9/h2-3,8,10H,4-7,13H2,1H3
InChIKeyJQZHQEWDKUVZPI-UHFFFAOYSA-N
XLogP1.59
TPSA51.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.17
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-[(2S)-4-benzylmorpholin-2-yl]ethanamine
CID 95396414
4-[(5-bromofuran-2-yl)methyl]-2-(bromomethyl)morpholine
CID 131047863
1-[4-[(4-bromo-3-chlorophenyl)methyl]morpholin-2-yl]ethanamine
CID 114077089
1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine
CID 81491103
(2S)-4-[(5-bromofuran-2-yl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
CID 99832541
(2R)-4-[(5-bromofuran-2-yl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
CID 99832542
1-[4-[(5-methylthiophen-2-yl)methyl]morpholin-2-yl]ethanamine
CID 115315061
1-[4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]ethanamine
CID 81490139
1-[4-[(4-nitrophenyl)methyl]morpholin-2-yl]ethanamine
CID 81491183
1-[4-[(4-chloro-2-pyridinyl)methyl]morpholin-2-yl]ethanamine
CID 115315468
4-[(5-bromofuran-2-yl)methyl]-6-methyl-1,4-oxazepane
CID 131213802
1-[4-[(4-pyrazol-1-ylphenyl)methyl]morpholin-2-yl]ethanamine
CID 81497211

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine?
The IUPAC name of 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine (CID 115314919) is 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine.
What is the SMILES notation for 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine?
The canonical SMILES for 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine is CC(N)C1CN(Cc2ccc(Br)o2)CCO1.
What is the InChIKey of 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine?
The InChIKey is JQZHQEWDKUVZPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN2O2/c1-8(13)10-7-14(4-5-15-10)6-9-2-3-11(12)16-9/h2-3,8,10H,4-7,13H2,1H3.
What are the key properties of 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine?
1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine has a molecular weight of 289.17 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine is sourced from PubChem (CID 115314919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).