(5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine

C15H19ClN2O2 — CID 114729898

IUPAC(5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine
SMILESCCN1CCOC(C(N)c2cc3cc(Cl)ccc3o2)C1
InChIInChI=1S/C15H19ClN2O2/c1-2-18-5-6-19-14(9-18)15(17)13-8-10-7-11(16)3-4-12(10)20-13/h3-4,7-8,14-15H,2,5-6,9,17H2,1H3
InChIKeyXTQKJJSSGWESJJ-UHFFFAOYSA-N
MW294.78 g/mol
LogP2.81
Rot. Bonds3

About (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine

(5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine (PubChem CID 114729898) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine
PubChem CID114729898
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC Name(5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine
SMILESCCN1CCOC(C(N)c2cc3cc(Cl)ccc3o2)C1
InChIInChI=1S/C15H19ClN2O2/c1-2-18-5-6-19-14(9-18)15(17)13-8-10-7-11(16)3-4-12(10)20-13/h3-4,7-8,14-15H,2,5-6,9,17H2,1H3
InChIKeyXTQKJJSSGWESJJ-UHFFFAOYSA-N
XLogP2.81
TPSA51.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(7-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine
CID 114729902
(3,5-dimethylphenyl)-(4-ethylmorpholin-2-yl)methanamine
CID 79667280
2-(4-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79666279
2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79666362
(5-chloro-1-benzofuran-2-yl)-(4-ethylcyclohexyl)methanamine
CID 114729198
(4-ethylmorpholin-2-yl)-(4-propylphenyl)methanamine
CID 79666018
(5-chloro-1-benzofuran-2-yl)-(4-propylcyclohexyl)methanamine
CID 114729243
2-(4-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 79666603
(4-chloro-1-ethylpyrazol-5-yl)-(4-ethylmorpholin-2-yl)methanamine
CID 114657772
(4-ethylmorpholin-2-yl)-(3-fluoro-4-methoxyphenyl)methanamine
CID 79667211
2-(4-chloro-2-fluorophenyl)-N-ethyl-1-(4-ethylmorpholin-2-yl)ethanamine
CID 114856460
2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 79666850

Frequently Asked Questions

What is the IUPAC name of (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine?
The IUPAC name of (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine (CID 114729898) is (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine.
What is the SMILES notation for (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine?
The canonical SMILES for (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine is CCN1CCOC(C(N)c2cc3cc(Cl)ccc3o2)C1.
What is the InChIKey of (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine?
The InChIKey is XTQKJJSSGWESJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c1-2-18-5-6-19-14(9-18)15(17)13-8-10-7-11(16)3-4-12(10)20-13/h3-4,7-8,14-15H,2,5-6,9,17H2,1H3.
What are the key properties of (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine?
(5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine has a molecular weight of 294.78 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine is sourced from PubChem (CID 114729898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).