N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide

C17H22N4O2 — CID 747077

IUPACN-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide
SMILESCN(C)c1cc(NC(=O)CN2CCOCC2)c2ccccc2n1
InChIInChI=1S/C17H22N4O2/c1-20(2)16-11-15(13-5-3-4-6-14(13)18-16)19-17(22)12-21-7-9-23-10-8-21/h3-6,11H,7-10,12H2,1-2H3,(H,18,19,22)
InChIKeyHZHDVJUPUBGUJO-UHFFFAOYSA-N
MW314.39 g/mol
LogP1.57
Rot. Bonds4

About N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide

N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide (PubChem CID 747077) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide
PubChem CID747077
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC NameN-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide
SMILESCN(C)c1cc(NC(=O)CN2CCOCC2)c2ccccc2n1
InChIInChI=1S/C17H22N4O2/c1-20(2)16-11-15(13-5-3-4-6-14(13)18-16)19-17(22)12-21-7-9-23-10-8-21/h3-6,11H,7-10,12H2,1-2H3,(H,18,19,22)
InChIKeyHZHDVJUPUBGUJO-UHFFFAOYSA-N
XLogP1.57
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide (CID 747077) is N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide is CN(C)c1cc(NC(=O)CN2CCOCC2)c2ccccc2n1.
What is the InChIKey of N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide?
The InChIKey is HZHDVJUPUBGUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-20(2)16-11-15(13-5-3-4-6-14(13)18-16)19-17(22)12-21-7-9-23-10-8-21/h3-6,11H,7-10,12H2,1-2H3,(H,18,19,22).
What are the key properties of N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide?
N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide has a molecular weight of 314.39 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)quinolin-4-yl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 747077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).