7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one

C16H21N3O3 — CID 22427117

IUPAC7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one
SMILESCC(C)C1Nc2ccc(C(=O)N3CCOCC3)cc2NC1=O
InChIInChI=1S/C16H21N3O3/c1-10(2)14-15(20)18-13-9-11(3-4-12(13)17-14)16(21)19-5-7-22-8-6-19/h3-4,9-10,14,17H,5-8H2,1-2H3,(H,18,20)
InChIKeyZRJKYVUNUQPEKS-UHFFFAOYSA-N
MW303.36 g/mol
LogP1.55
Rot. Bonds2

About 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one

7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one (PubChem CID 22427117) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one.

Molecular Properties

Compound Name7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one
PubChem CID22427117
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one
SMILESCC(C)C1Nc2ccc(C(=O)N3CCOCC3)cc2NC1=O
InChIInChI=1S/C16H21N3O3/c1-10(2)14-15(20)18-13-9-11(3-4-12(13)17-14)16(21)19-5-7-22-8-6-19/h3-4,9-10,14,17H,5-8H2,1-2H3,(H,18,20)
InChIKeyZRJKYVUNUQPEKS-UHFFFAOYSA-N
XLogP1.55
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one with MolForge

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Related Compounds

7-(4-ethylpiperazine-1-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one
CID 22427120
3-butan-2-yl-7-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one
CID 22427162
2-butan-2-yl-N-(3-morpholin-4-ylpropyl)-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide
CID 22427174
4,4-dimethyl-6-(morpholine-4-carbonyl)-1,3-dihydroquinolin-2-one
CID 91946268
(2-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-morpholin-4-ylmethanone
CID 102567774
6-(4-methylpiperidine-1-carbonyl)-2-morpholin-4-yl-4H-1,4-benzothiazin-3-one
CID 5122142
2-methyl-6-(pyrrolidine-1-carbonyl)-4H-1,4-benzoxazin-3-one
CID 110683016
3-methylidene-5-(morpholine-4-carbonyl)-1H-indol-2-one
CID 89153263
2,3-dihydro-1H-indol-6-yl(morpholin-4-yl)methanone
CID 90299623
[4-hydroxy-3-(3-methylbutan-2-yl)phenyl]-morpholin-4-ylmethanone
CID 59382251
6-(4-acetyl-1,4-diazepane-1-carbonyl)-2-methyl-4H-1,4-benzoxazin-3-one
CID 110805560
2-methyl-6-[4-(3-methylbutanoyl)-1,4-diazepane-1-carbonyl]-4H-1,4-benzoxazin-3-one
CID 110806909

Frequently Asked Questions

What is the IUPAC name of 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one?
The IUPAC name of 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one (CID 22427117) is 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one.
What is the SMILES notation for 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one?
The canonical SMILES for 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one is CC(C)C1Nc2ccc(C(=O)N3CCOCC3)cc2NC1=O.
What is the InChIKey of 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one?
The InChIKey is ZRJKYVUNUQPEKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-10(2)14-15(20)18-13-9-11(3-4-12(13)17-14)16(21)19-5-7-22-8-6-19/h3-4,9-10,14,17H,5-8H2,1-2H3,(H,18,20).
What are the key properties of 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one?
7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one has a molecular weight of 303.36 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(morpholine-4-carbonyl)-3-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one is sourced from PubChem (CID 22427117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).