[2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone

C20H20N6O2 — CID 139470055

IUPAC[2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone
SMILESCC1=NC2=NCNN2C(C2CN(C(=O)c3cnc4ccccc4c3)CCO2)=C1
InChIInChI=1S/C20H20N6O2/c1-13-8-17(26-20(24-13)22-12-23-26)18-11-25(6-7-28-18)19(27)15-9-14-4-2-3-5-16(14)21-10-15/h2-5,8-10,18,23H,6-7,11-12H2,1H3
InChIKeyVHCYDOSXENSSPC-UHFFFAOYSA-N
MW376.42 g/mol
LogP1.57
Rot. Bonds2

About [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone

[2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone (PubChem CID 139470055) has the molecular formula C20H20N6O2 and a molecular weight of 376.42 g/mol. Its IUPAC name is [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone.

Molecular Properties

Compound Name[2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone
PubChem CID139470055
Molecular FormulaC20H20N6O2
Molecular Weight376.42 g/mol
Exact Mass376.16
IUPAC Name[2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone
SMILESCC1=NC2=NCNN2C(C2CN(C(=O)c3cnc4ccccc4c3)CCO2)=C1
InChIInChI=1S/C20H20N6O2/c1-13-8-17(26-20(24-13)22-12-23-26)18-11-25(6-7-28-18)19(27)15-9-14-4-2-3-5-16(14)21-10-15/h2-5,8-10,18,23H,6-7,11-12H2,1H3
InChIKeyVHCYDOSXENSSPC-UHFFFAOYSA-N
XLogP1.57
TPSA82.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone with MolForge

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

Launch Full Analysis

Related Compounds

(4-methoxy-3-methylphenyl)-[2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]methanone
CID 166785959
[2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-quinolin-3-ylmethanone
CID 110113455
[(2R)-2-(4-methylpyrimidin-2-yl)morpholin-4-yl]-quinolin-3-ylmethanone
CID 124959536
[(2S)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]-quinolin-3-ylmethanone
CID 125018611
[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-quinolin-6-ylmethanone
CID 110115591
(1-methylpyrazolo[4,5-b]pyridin-6-yl)-(2-pyridin-2-ylmorpholin-4-yl)methanone
CID 157018438
(2-pyrazin-2-ylmorpholin-4-yl)-quinolin-6-ylmethanone
CID 110103222
4-methyl-2-[(2S)-4-(quinoline-6-carbonyl)morpholin-2-yl]-1H-pyrimidin-6-one
CID 137037891
(4aS,8aS)-6-(quinoline-3-carbonyl)-4,4a,5,7,8,8a-hexahydropyrido[4,3-b][1,4]oxazin-3-one
CID 110147216
(4aS,7aS)-4-methyl-6-(quinoline-3-carbonyl)-4a,5,7,7a-tetrahydropyrrolo[3,4-b][1,4]oxazin-3-one
CID 125212354
[2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]-quinoxalin-2-ylmethanone
CID 127781397
[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-(2-methylpyrimidin-5-yl)methanone
CID 95228845

Frequently Asked Questions

What is the IUPAC name of [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone?
The IUPAC name of [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone (CID 139470055) is [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone.
What is the SMILES notation for [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone?
The canonical SMILES for [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone is CC1=NC2=NCNN2C(C2CN(C(=O)c3cnc4ccccc4c3)CCO2)=C1.
What is the InChIKey of [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone?
The InChIKey is VHCYDOSXENSSPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N6O2/c1-13-8-17(26-20(24-13)22-12-23-26)18-11-25(6-7-28-18)19(27)15-9-14-4-2-3-5-16(14)21-10-15/h2-5,8-10,18,23H,6-7,11-12H2,1H3.
What are the key properties of [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone?
[2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone has a molecular weight of 376.42 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-methyl-1,2-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholin-4-yl]-quinolin-3-ylmethanone is sourced from PubChem (CID 139470055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).