2-morpholin-4-ylaniline;dihydrochloride

C10H16Cl2N2O — CID 75481890

IUPAC2-morpholin-4-ylaniline;dihydrochloride
SMILESCl.Cl.Nc1ccccc1N1CCOCC1
InChIInChI=1S/C10H14N2O.2ClH/c11-9-3-1-2-4-10(9)12-5-7-13-8-6-12;;/h1-4H,5-8,11H2;2*1H
InChIKeyARXAJTIEZQKMAF-UHFFFAOYSA-N
MW251.16 g/mol
LogP1.95
Rot. Bonds1

About 2-morpholin-4-ylaniline;dihydrochloride

2-morpholin-4-ylaniline;dihydrochloride (PubChem CID 75481890) has the molecular formula C10H16Cl2N2O and a molecular weight of 251.16 g/mol. Its IUPAC name is 2-morpholin-4-ylaniline;dihydrochloride.

Molecular Properties

Compound Name2-morpholin-4-ylaniline;dihydrochloride
PubChem CID75481890
Molecular FormulaC10H16Cl2N2O
Molecular Weight251.16 g/mol
Exact Mass250.06
IUPAC Name2-morpholin-4-ylaniline;dihydrochloride
SMILESCl.Cl.Nc1ccccc1N1CCOCC1
InChIInChI=1S/C10H14N2O.2ClH/c11-9-3-1-2-4-10(9)12-5-7-13-8-6-12;;/h1-4H,5-8,11H2;2*1H
InChIKeyARXAJTIEZQKMAF-UHFFFAOYSA-N
XLogP1.95
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylaniline;dihydrochloride?
The IUPAC name of 2-morpholin-4-ylaniline;dihydrochloride (CID 75481890) is 2-morpholin-4-ylaniline;dihydrochloride.
What is the SMILES notation for 2-morpholin-4-ylaniline;dihydrochloride?
The canonical SMILES for 2-morpholin-4-ylaniline;dihydrochloride is Cl.Cl.Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylaniline;dihydrochloride?
The InChIKey is ARXAJTIEZQKMAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.2ClH/c11-9-3-1-2-4-10(9)12-5-7-13-8-6-12;;/h1-4H,5-8,11H2;2*1H.
What are the key properties of 2-morpholin-4-ylaniline;dihydrochloride?
2-morpholin-4-ylaniline;dihydrochloride has a molecular weight of 251.16 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylaniline;dihydrochloride is sourced from PubChem (CID 75481890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).