2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine

C16H23N5O — CID 648149

IUPAC2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine
SMILESCC1CCc2c(nc3ncnn3c2N2CC(C)OC(C)C2)C1
InChIInChI=1S/C16H23N5O/c1-10-4-5-13-14(6-10)19-16-17-9-18-21(16)15(13)20-7-11(2)22-12(3)8-20/h9-12H,4-8H2,1-3H3
InChIKeyJGXWJZGRCQFLOC-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.86
Rot. Bonds1

About 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine

2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine (PubChem CID 648149) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine
PubChem CID648149
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC Name2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine
SMILESCC1CCc2c(nc3ncnn3c2N2CC(C)OC(C)C2)C1
InChIInChI=1S/C16H23N5O/c1-10-4-5-13-14(6-10)19-16-17-9-18-21(16)15(13)20-7-11(2)22-12(3)8-20/h9-12H,4-8H2,1-3H3
InChIKeyJGXWJZGRCQFLOC-UHFFFAOYSA-N
XLogP1.86
TPSA55.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine 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

9-Morpholin-4-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazoline
CID 654158
9-(2,6-Dimethyl-morpholin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazoline
CID 655833
4-Morpholin-4-yl-5,6,7,8-tetrahydro-1,2,3,3a,9-pentaaza-cyclopenta[b]naphthalene
CID 652418
4-[3-(7-Methyl-1,3,8,10,12-pentazatricyclo[7.3.0.02,6]dodeca-2(6),7,9,11-tetraen-3-yl)propyl]morpholine
CID 12666104
4-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-2-[(4-methylpyrazol-1-yl)methyl]morpholine
CID 53565438
4-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-2-(1,2,4-triazol-1-ylmethyl)morpholine
CID 72044444
N~4~-{[4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]methyl}-N~4~-methyl-5,6,7,8-tetrahydroquinazoline-2,4-diamine
CID 72854321
1-{5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-9-yl}pyrrolidine
CID 46094469
9-[4-(3-Methylpiperidin-1-yl)piperidin-1-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazoline
CID 46097483
9-(Azonan-1-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazoline
CID 46096735
9-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazoline
CID 46096758
9-[4-[(3S)-3-methylpiperidin-1-yl]piperidin-1-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazoline
CID 92758599

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine?
The IUPAC name of 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine (CID 648149) is 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine.
What is the SMILES notation for 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine?
The canonical SMILES for 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine is CC1CCc2c(nc3ncnn3c2N2CC(C)OC(C)C2)C1.
What is the InChIKey of 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine?
The InChIKey is JGXWJZGRCQFLOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-10-4-5-13-14(6-10)19-16-17-9-18-21(16)15(13)20-7-11(2)22-12(3)8-20/h9-12H,4-8H2,1-3H3.
What are the key properties of 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine?
2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine has a molecular weight of 301.39 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)morpholine is sourced from PubChem (CID 648149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).