[4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine

C13H19ClN2O2 — CID 114322345

IUPAC[4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine
SMILESNCc1ccc(Cl)cc1OCCN1CCOCC1
InChIInChI=1S/C13H19ClN2O2/c14-12-2-1-11(10-15)13(9-12)18-8-5-16-3-6-17-7-4-16/h1-2,9H,3-8,10,15H2
InChIKeyZFGMITNTNSDXAI-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.51
Rot. Bonds5

About [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine

[4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine (PubChem CID 114322345) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine.

Molecular Properties

Compound Name[4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine
PubChem CID114322345
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC Name[4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine
SMILESNCc1ccc(Cl)cc1OCCN1CCOCC1
InChIInChI=1S/C13H19ClN2O2/c14-12-2-1-11(10-15)13(9-12)18-8-5-16-3-6-17-7-4-16/h1-2,9H,3-8,10,15H2
InChIKeyZFGMITNTNSDXAI-UHFFFAOYSA-N
XLogP1.51
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-chloro-2-(2-piperidin-1-ylethoxy)phenyl]methanamine
CID 55179828
[3-(2-morpholin-4-ylethoxy)-4-pyridinyl]methanamine
CID 142566545
(1R)-1-[5-chloro-2-(2-morpholin-4-ylethoxy)phenyl]ethanamine
CID 55189907
N-[[5-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methyl]cyclopropanamine
CID 60883333
4-[2-(2-chloro-5-iodophenoxy)ethyl]morpholine
CID 122524434
4-[2-(2,3-dichlorophenoxy)ethyl]morpholine
CID 869488
4-[2-[2-(chloromethyl)phenoxy]ethyl]morpholine
CID 18179953
4-[2-(5-chloro-2-ethoxyphenyl)ethyl]morpholine;methanamine
CID 177027735
[2-ethoxy-4-(morpholin-4-ylmethyl)phenyl]methanamine
CID 84754907
[4-chloro-2-(oxolan-3-ylmethoxy)phenyl]methanamine
CID 63081811
3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide
CID 22318780
2-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]ethanamine
CID 22687397

Frequently Asked Questions

What is the IUPAC name of [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine?
The IUPAC name of [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine (CID 114322345) is [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine.
What is the SMILES notation for [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine?
The canonical SMILES for [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine is NCc1ccc(Cl)cc1OCCN1CCOCC1.
What is the InChIKey of [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine?
The InChIKey is ZFGMITNTNSDXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c14-12-2-1-11(10-15)13(9-12)18-8-5-16-3-6-17-7-4-16/h1-2,9H,3-8,10,15H2.
What are the key properties of [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine?
[4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine has a molecular weight of 270.76 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methanamine is sourced from PubChem (CID 114322345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).