2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine

C12H17ClN2O — CID 114860184

IUPAC2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine
SMILESNCCc1ccc(Cl)cc1N1CCOCC1
InChIInChI=1S/C12H17ClN2O/c13-11-2-1-10(3-4-14)12(9-11)15-5-7-16-8-6-15/h1-2,9H,3-8,14H2
InChIKeyJYIZUXAGMFCETH-UHFFFAOYSA-N
MW240.73 g/mol
LogP1.68
Rot. Bonds3

About 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine

2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine (PubChem CID 114860184) has the molecular formula C12H17ClN2O and a molecular weight of 240.73 g/mol. Its IUPAC name is 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine
PubChem CID114860184
Molecular FormulaC12H17ClN2O
Molecular Weight240.73 g/mol
Exact Mass240.10
IUPAC Name2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine
SMILESNCCc1ccc(Cl)cc1N1CCOCC1
InChIInChI=1S/C12H17ClN2O/c13-11-2-1-10(3-4-14)12(9-11)15-5-7-16-8-6-15/h1-2,9H,3-8,14H2
InChIKeyJYIZUXAGMFCETH-UHFFFAOYSA-N
XLogP1.68
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-chloro-2-(1,3-dihydroisoindol-2-yl)phenyl]ethanamine
CID 114860770
2-(5-fluoro-2-morpholin-4-ylphenyl)ethanamine
CID 63784729
4-(4-methyl-2-morpholin-4-ylphenyl)butan-1-amine
CID 117115698
N-[[4-chloro-2-(1,4-oxazepan-4-yl)phenyl]methyl]ethanamine
CID 114850847
N-[[4-chloro-2-(1,4-oxazepan-4-yl)phenyl]methyl]-2-methylpropan-2-amine
CID 114850835
2-[4-chloro-2-(2,6-dimethylthiomorpholin-4-yl)phenyl]ethanamine
CID 114861712
2-(5-chloro-2-piperidin-1-ylphenyl)ethanamine
CID 114860401
2-(4-morpholin-4-yl-3-pyridinyl)ethanamine
CID 83883289
2-[4-chloro-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)phenyl]ethanamine
CID 114860944
1-(5-chloro-2-morpholin-4-ylphenyl)-2-methylpropan-2-amine
CID 117425635
2-amino-1-(5-chloro-2-morpholin-4-ylphenyl)ethanone
CID 117390088
2-[2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-4-chlorophenyl]ethanamine
CID 114861027

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine?
The IUPAC name of 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine (CID 114860184) is 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine.
What is the SMILES notation for 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine?
The canonical SMILES for 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine is NCCc1ccc(Cl)cc1N1CCOCC1.
What is the InChIKey of 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine?
The InChIKey is JYIZUXAGMFCETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O/c13-11-2-1-10(3-4-14)12(9-11)15-5-7-16-8-6-15/h1-2,9H,3-8,14H2.
What are the key properties of 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine?
2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine has a molecular weight of 240.73 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-morpholin-4-ylphenyl)ethanamine is sourced from PubChem (CID 114860184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).