2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one

C20H26F2N4O4 — CID 76534615

IUPAC2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one
SMILESCC1Cc2c(OC(F)F)cccc2N1C(=O)CC1NC(=O)CC(N2CCOCC2)N1
InChIInChI=1S/C20H26F2N4O4/c1-12-9-13-14(3-2-4-15(13)30-20(21)22)26(12)19(28)10-16-23-17(11-18(27)24-16)25-5-7-29-8-6-25/h2-4,12,16-17,20,23H,5-11H2,1H3,(H,24,27)
InChIKeyIDVPRGNZQSPUDV-UHFFFAOYSA-N
MW424.45 g/mol
LogP1.05
Rot. Bonds5

About 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one

2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one (PubChem CID 76534615) has the molecular formula C20H26F2N4O4 and a molecular weight of 424.45 g/mol. Its IUPAC name is 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one.

Molecular Properties

Compound Name2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one
PubChem CID76534615
Molecular FormulaC20H26F2N4O4
Molecular Weight424.45 g/mol
Exact Mass424.19
IUPAC Name2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one
SMILESCC1Cc2c(OC(F)F)cccc2N1C(=O)CC1NC(=O)CC(N2CCOCC2)N1
InChIInChI=1S/C20H26F2N4O4/c1-12-9-13-14(3-2-4-15(13)30-20(21)22)26(12)19(28)10-16-23-17(11-18(27)24-16)25-5-7-29-8-6-25/h2-4,12,16-17,20,23H,5-11H2,1H3,(H,24,27)
InChIKeyIDVPRGNZQSPUDV-UHFFFAOYSA-N
XLogP1.05
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.45
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one?
The IUPAC name of 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one (CID 76534615) is 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one.
What is the SMILES notation for 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one?
The canonical SMILES for 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one is CC1Cc2c(OC(F)F)cccc2N1C(=O)CC1NC(=O)CC(N2CCOCC2)N1.
What is the InChIKey of 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one?
The InChIKey is IDVPRGNZQSPUDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26F2N4O4/c1-12-9-13-14(3-2-4-15(13)30-20(21)22)26(12)19(28)10-16-23-17(11-18(27)24-16)25-5-7-29-8-6-25/h2-4,12,16-17,20,23H,5-11H2,1H3,(H,24,27).
What are the key properties of 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one?
2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one has a molecular weight of 424.45 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-1,3-diazinan-4-one is sourced from PubChem (CID 76534615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).