4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one

C19H23N5O3 — CID 74239896

IUPAC4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one
SMILESCOCCc1nc(C2CNCCO2)n(-c2cc(=O)n(C)c3ccccc23)n1
InChIInChI=1S/C19H23N5O3/c1-23-14-6-4-3-5-13(14)15(11-18(23)25)24-19(16-12-20-8-10-27-16)21-17(22-24)7-9-26-2/h3-6,11,16,20H,7-10,12H2,1-2H3
InChIKeyZAASBSUBHOQSTE-UHFFFAOYSA-N
MW369.43 g/mol
LogP0.97
Rot. Bonds5

About 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one

4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one (PubChem CID 74239896) has the molecular formula C19H23N5O3 and a molecular weight of 369.43 g/mol. Its IUPAC name is 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one.

Molecular Properties

Compound Name4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one
PubChem CID74239896
Molecular FormulaC19H23N5O3
Molecular Weight369.43 g/mol
Exact Mass369.18
IUPAC Name4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one
SMILESCOCCc1nc(C2CNCCO2)n(-c2cc(=O)n(C)c3ccccc23)n1
InChIInChI=1S/C19H23N5O3/c1-23-14-6-4-3-5-13(14)15(11-18(23)25)24-19(16-12-20-8-10-27-16)21-17(22-24)7-9-26-2/h3-6,11,16,20H,7-10,12H2,1-2H3
InChIKeyZAASBSUBHOQSTE-UHFFFAOYSA-N
XLogP0.97
TPSA83.20 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one with MolForge

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Related Compounds

2-[1-(2-methoxyethyl)benzimidazol-2-yl]morpholine;dihydrochloride
CID 170916966
(2S)-2-[[2-(2-methoxyphenyl)-5-(2-phenylethyl)-1,2,4-triazol-3-yl]methyl]morpholine
CID 97445359
(2R)-2-[[2-(2-methoxyphenyl)-5-(2-phenylethyl)-1,2,4-triazol-3-yl]methyl]morpholine
CID 97445358
(2R)-2-(4-methyl-1,2,4-triazol-3-yl)morpholine
CID 94552518
5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one
CID 10570239
2-[(2S)-morpholin-2-yl]-3H-quinazolin-4-one
CID 178029081
N-(2-methoxyethyl)-3-[(2R)-morpholin-2-yl]-1-benzothiophene-2-carboxamide
CID 93083359
2-(1,5-dimethylpyrazol-3-yl)morpholine
CID 82601049
(2R)-2-[3-(2-phenylethyl)-1,2,4-oxadiazol-5-yl]morpholine
CID 120834209
3-[[(6S,7R)-7-(4-chloro-3-fluorophenyl)-1,4-oxazepan-6-yl]methyl]-1-methylquinazoline-2,4-dione
CID 66975391
2-(2-methoxy-5-methylpyrrolo[3,2-d]pyrimidin-7-yl)morpholine
CID 82665137
2-(3-bromo-1-methylindazol-4-yl)morpholine
CID 117477160

Frequently Asked Questions

What is the IUPAC name of 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one?
The IUPAC name of 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one (CID 74239896) is 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one.
What is the SMILES notation for 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one?
The canonical SMILES for 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one is COCCc1nc(C2CNCCO2)n(-c2cc(=O)n(C)c3ccccc23)n1.
What is the InChIKey of 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one?
The InChIKey is ZAASBSUBHOQSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3/c1-23-14-6-4-3-5-13(14)15(11-18(23)25)24-19(16-12-20-8-10-27-16)21-17(22-24)7-9-26-2/h3-6,11,16,20H,7-10,12H2,1-2H3.
What are the key properties of 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one?
4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one has a molecular weight of 369.43 g/mol, XLogP of 0.97, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2-methoxyethyl)-5-morpholin-2-yl-1,2,4-triazol-1-yl]-1-methylquinolin-2-one is sourced from PubChem (CID 74239896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).