6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride

C15H25Cl2N3O2 — CID 155836671

IUPAC6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride
SMILESCl.Cl.NC1CCc2c(ccc(=O)n2CCN2CCOCC2)C1
InChIInChI=1S/C15H23N3O2.2ClH/c16-13-2-3-14-12(11-13)1-4-15(19)18(14)6-5-17-7-9-20-10-8-17;;/h1,4,13H,2-3,5-11,16H2;2*1H
InChIKeyRQUZAIWDWYQAMO-UHFFFAOYSA-N
MW350.29 g/mol
LogP0.84
Rot. Bonds3

About 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride

6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride (PubChem CID 155836671) has the molecular formula C15H25Cl2N3O2 and a molecular weight of 350.29 g/mol. Its IUPAC name is 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride.

Molecular Properties

Compound Name6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride
PubChem CID155836671
Molecular FormulaC15H25Cl2N3O2
Molecular Weight350.29 g/mol
Exact Mass349.13
IUPAC Name6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride
SMILESCl.Cl.NC1CCc2c(ccc(=O)n2CCN2CCOCC2)C1
InChIInChI=1S/C15H23N3O2.2ClH/c16-13-2-3-14-12(11-13)1-4-15(19)18(14)6-5-17-7-9-20-10-8-17;;/h1,4,13H,2-3,5-11,16H2;2*1H
InChIKeyRQUZAIWDWYQAMO-UHFFFAOYSA-N
XLogP0.84
TPSA60.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.29
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride?
The IUPAC name of 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride (CID 155836671) is 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride.
What is the SMILES notation for 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride?
The canonical SMILES for 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride is Cl.Cl.NC1CCc2c(ccc(=O)n2CCN2CCOCC2)C1.
What is the InChIKey of 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride?
The InChIKey is RQUZAIWDWYQAMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2.2ClH/c16-13-2-3-14-12(11-13)1-4-15(19)18(14)6-5-17-7-9-20-10-8-17;;/h1,4,13H,2-3,5-11,16H2;2*1H.
What are the key properties of 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride?
6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride has a molecular weight of 350.29 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-(2-morpholin-4-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride is sourced from PubChem (CID 155836671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).