3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one

C11H15N5O2 — CID 139494738

IUPAC3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one
SMILESCc1nc(N2CCOCC2)n2ncn(C)c(=O)c12
InChIInChI=1S/C11H15N5O2/c1-8-9-10(17)14(2)7-12-16(9)11(13-8)15-3-5-18-6-4-15/h7H,3-6H2,1-2H3
InChIKeyFWOJLQQKMTXZEE-UHFFFAOYSA-N
MW249.27 g/mol
LogP-0.43
Rot. Bonds1

About 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one

3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one (PubChem CID 139494738) has the molecular formula C11H15N5O2 and a molecular weight of 249.27 g/mol. Its IUPAC name is 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one.

Molecular Properties

Compound Name3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one
PubChem CID139494738
Molecular FormulaC11H15N5O2
Molecular Weight249.27 g/mol
Exact Mass249.12
IUPAC Name3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one
SMILESCc1nc(N2CCOCC2)n2ncn(C)c(=O)c12
InChIInChI=1S/C11H15N5O2/c1-8-9-10(17)14(2)7-12-16(9)11(13-8)15-3-5-18-6-4-15/h7H,3-6H2,1-2H3
InChIKeyFWOJLQQKMTXZEE-UHFFFAOYSA-N
XLogP-0.43
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 5-0.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

3-amino-2-methyl-7-morpholin-4-ylpyrimido[1,2-b]pyridazin-4-one
CID 82090462
2-methyl-3-morpholin-4-yl-1H-1,2,4-triazol-5-one
CID 19390520
6,8-dimethyl-2-morpholin-4-ylpteridin-7-one
CID 3234245
5,13-dimethyl-11-morpholin-4-yl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,10,12-pentaen-6-one
CID 53368200
4-methyl-2-(2-morpholin-4-ylethyl)-1,2,4-triazol-3-one
CID 115773650
8-(1-bromoethyl)-3,6-dimethyl-2-morpholin-4-ylquinazolin-4-one
CID 170753277
4-(5-bromo-2-methyl-1,2,4-triazol-3-yl)morpholine
CID 51000286
2-methyl-6-morpholin-4-ylpyridine-3-carbaldehyde
CID 102544177
7-[(2R)-2-hydroxypropyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione
CID 7214251
3,7-dimethyl-1-[(4-methylphenyl)methyl]-8-morpholin-4-ylpurine-2,6-dione
CID 16805193
2-methyl-6-morpholin-4-ylpyridine-3-carboxylic acid
CID 67287742
5-(4-methylphenyl)-6-morpholin-4-yl-1-phenylpyrazolo[5,4-d]pyrimidin-4-one
CID 143223329

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one?
The IUPAC name of 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one (CID 139494738) is 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one.
What is the SMILES notation for 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one?
The canonical SMILES for 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one is Cc1nc(N2CCOCC2)n2ncn(C)c(=O)c12.
What is the InChIKey of 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one?
The InChIKey is FWOJLQQKMTXZEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2/c1-8-9-10(17)14(2)7-12-16(9)11(13-8)15-3-5-18-6-4-15/h7H,3-6H2,1-2H3.
What are the key properties of 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one?
3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one has a molecular weight of 249.27 g/mol, XLogP of -0.43, 1 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-7-morpholin-4-ylimidazo[5,1-f][1,2,4]triazin-4-one is sourced from PubChem (CID 139494738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).