2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine

C14H21ClN2O — CID 79666362

IUPAC2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
SMILESCCN1CCOC(C(N)Cc2cccc(Cl)c2)C1
InChIInChI=1S/C14H21ClN2O/c1-2-17-6-7-18-14(10-17)13(16)9-11-4-3-5-12(15)8-11/h3-5,8,13-14H,2,6-7,9-10,16H2,1H3
InChIKeyCCZCOHWKGLJEAR-UHFFFAOYSA-N
MW268.79 g/mol
LogP1.93
Rot. Bonds4

About 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine

2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine (PubChem CID 79666362) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
PubChem CID79666362
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC Name2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
SMILESCCN1CCOC(C(N)Cc2cccc(Cl)c2)C1
InChIInChI=1S/C14H21ClN2O/c1-2-17-6-7-18-14(10-17)13(16)9-11-4-3-5-12(15)8-11/h3-5,8,13-14H,2,6-7,9-10,16H2,1H3
InChIKeyCCZCOHWKGLJEAR-UHFFFAOYSA-N
XLogP1.93
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanol
CID 79666850
1-(4-ethylmorpholin-2-yl)-2-(3-fluorophenyl)ethanamine
CID 79666865
2-(4-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79666279
2-(4-tert-butylphenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79665528
1-(4-ethylmorpholin-2-yl)-2-thiophen-3-ylethanamine
CID 79667283
2-(3-bromo-5-fluorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79708989
1-(4-ethylmorpholin-2-yl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 79666951
2-(2,5-dimethylphenyl)-1-(4-ethylmorpholin-2-yl)ethanamine
CID 79667291
2-(2,5-dichlorophenyl)-1-(4-propylmorpholin-2-yl)ethanamine
CID 79657387
(4-ethylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanol
CID 116543719
(5-chloro-1-benzofuran-2-yl)-(4-ethylmorpholin-2-yl)methanamine
CID 114729898
2-(2,3-dichlorophenyl)-1-(4-propylmorpholin-2-yl)ethanamine
CID 107308854

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine?
The IUPAC name of 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine (CID 79666362) is 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine.
What is the SMILES notation for 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine?
The canonical SMILES for 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine is CCN1CCOC(C(N)Cc2cccc(Cl)c2)C1.
What is the InChIKey of 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine?
The InChIKey is CCZCOHWKGLJEAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O/c1-2-17-6-7-18-14(10-17)13(16)9-11-4-3-5-12(15)8-11/h3-5,8,13-14H,2,6-7,9-10,16H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine?
2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine has a molecular weight of 268.79 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-(4-ethylmorpholin-2-yl)ethanamine is sourced from PubChem (CID 79666362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).