7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione

C15H18N2O4 — CID 51054568

IUPAC7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione
SMILESCC1CC(=O)c2cc(C(=O)N3CCOCC3)c(=O)[nH]c2C1
InChIInChI=1S/C15H18N2O4/c1-9-6-12-10(13(18)7-9)8-11(14(19)16-12)15(20)17-2-4-21-5-3-17/h8-9H,2-7H2,1H3,(H,16,19)
InChIKeyHXXRCAVFFVBDPI-UHFFFAOYSA-N
MW290.32 g/mol
LogP0.61
Rot. Bonds1

About 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione

7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione (PubChem CID 51054568) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione.

Molecular Properties

Compound Name7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione
PubChem CID51054568
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione
SMILESCC1CC(=O)c2cc(C(=O)N3CCOCC3)c(=O)[nH]c2C1
InChIInChI=1S/C15H18N2O4/c1-9-6-12-10(13(18)7-9)8-11(14(19)16-12)15(20)17-2-4-21-5-3-17/h8-9H,2-7H2,1H3,(H,16,19)
InChIKeyHXXRCAVFFVBDPI-UHFFFAOYSA-N
XLogP0.61
TPSA79.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione?
The IUPAC name of 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione (CID 51054568) is 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione.
What is the SMILES notation for 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione?
The canonical SMILES for 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione is CC1CC(=O)c2cc(C(=O)N3CCOCC3)c(=O)[nH]c2C1.
What is the InChIKey of 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione?
The InChIKey is HXXRCAVFFVBDPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-9-6-12-10(13(18)7-9)8-11(14(19)16-12)15(20)17-2-4-21-5-3-17/h8-9H,2-7H2,1H3,(H,16,19).
What are the key properties of 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione?
7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione has a molecular weight of 290.32 g/mol, XLogP of 0.61, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(morpholine-4-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione is sourced from PubChem (CID 51054568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).