N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide

C21H21N3O3 — CID 4879545

IUPACN-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide
SMILESO=C(COc1cccc2cccnc12)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C21H21N3O3/c25-20(15-27-19-9-3-5-16-6-4-10-22-21(16)19)23-17-7-1-2-8-18(17)24-11-13-26-14-12-24/h1-10H,11-15H2,(H,23,25)
InChIKeyZJRDHGFMVANNGO-UHFFFAOYSA-N
MW363.42 g/mol
LogP3.09
Rot. Bonds5

About N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide

N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide (PubChem CID 4879545) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide
PubChem CID4879545
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC NameN-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide
SMILESO=C(COc1cccc2cccnc12)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C21H21N3O3/c25-20(15-27-19-9-3-5-16-6-4-10-22-21(16)19)23-17-7-1-2-8-18(17)24-11-13-26-14-12-24/h1-10H,11-15H2,(H,23,25)
InChIKeyZJRDHGFMVANNGO-UHFFFAOYSA-N
XLogP3.09
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide?
The IUPAC name of N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide (CID 4879545) is N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide.
What is the SMILES notation for N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide?
The canonical SMILES for N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide is O=C(COc1cccc2cccnc12)Nc1ccccc1N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide?
The InChIKey is ZJRDHGFMVANNGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3/c25-20(15-27-19-9-3-5-16-6-4-10-22-21(16)19)23-17-7-1-2-8-18(17)24-11-13-26-14-12-24/h1-10H,11-15H2,(H,23,25).
What are the key properties of N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide?
N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide has a molecular weight of 363.42 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide is sourced from PubChem (CID 4879545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).