(2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine

C14H20N6O — CID 129338053

IUPAC(2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine
SMILESCC(C)c1nccc(N2CCO[C@@H](c3nncn3C)C2)n1
InChIInChI=1S/C14H20N6O/c1-10(2)13-15-5-4-12(17-13)20-6-7-21-11(8-20)14-18-16-9-19(14)3/h4-5,9-11H,6-8H2,1-3H3/t11-/m1/s1
InChIKeyTVRULJQFNKPREU-LLVKDONJSA-N
MW288.36 g/mol
LogP1.31
Rot. Bonds3

About (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine

(2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine (PubChem CID 129338053) has the molecular formula C14H20N6O and a molecular weight of 288.36 g/mol. Its IUPAC name is (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name(2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine
PubChem CID129338053
Molecular FormulaC14H20N6O
Molecular Weight288.36 g/mol
Exact Mass288.17
IUPAC Name(2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine
SMILESCC(C)c1nccc(N2CCO[C@@H](c3nncn3C)C2)n1
InChIInChI=1S/C14H20N6O/c1-10(2)13-15-5-4-12(17-13)20-6-7-21-11(8-20)14-18-16-9-19(14)3/h4-5,9-11H,6-8H2,1-3H3/t11-/m1/s1
InChIKeyTVRULJQFNKPREU-LLVKDONJSA-N
XLogP1.31
TPSA68.96 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-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

(2R)-4-[2,6-di(propan-2-yl)pyrimidin-4-yl]-2-(4-methyl-1,2,4-triazol-3-yl)morpholine
CID 129339901
2-(4-ethyl-1,2,4-triazol-3-yl)-4-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]morpholine
CID 154755868
4-[3-(furan-2-yl)pyrrolidin-1-yl]-2-propan-2-ylpyrimidine
CID 136524880
(3R)-N-methyl-1-(2-propan-2-ylpyrimidin-4-yl)pyrrolidin-3-amine
CID 118720438
4-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2,6-di(propan-2-yl)pyrimidine
CID 122138214
2-(4-ethyl-1,2,4-triazol-3-yl)-4-pyridin-2-ylmorpholine
CID 126807770
2-fluoro-6-[2-(4-methyl-1,2,4-triazol-3-yl)morpholin-4-yl]benzonitrile
CID 129005614
4-[2-(4-methoxyphenyl)propyl]-2-(4-methyl-1,2,4-triazol-3-yl)morpholine
CID 129007338
4-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-phenylpyrimidine
CID 51108750
(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-(4-methoxypyrimidin-2-yl)morpholine
CID 129334871
4-(2,5-dimethylthieno[2,3-d]pyrimidin-4-yl)-2-(4-methyl-1,2,4-triazol-3-yl)morpholine
CID 129006956
(2S)-2-cyclopropyl-1-[(2R)-2-(4-methyl-1,2,4-triazol-3-yl)morpholin-4-yl]-2-phenylethanone
CID 129328732

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine?
The IUPAC name of (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine (CID 129338053) is (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine.
What is the SMILES notation for (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine?
The canonical SMILES for (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine is CC(C)c1nccc(N2CCO[C@@H](c3nncn3C)C2)n1.
What is the InChIKey of (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine?
The InChIKey is TVRULJQFNKPREU-LLVKDONJSA-N. The full InChI is InChI=1S/C14H20N6O/c1-10(2)13-15-5-4-12(17-13)20-6-7-21-11(8-20)14-18-16-9-19(14)3/h4-5,9-11H,6-8H2,1-3H3/t11-/m1/s1.
What are the key properties of (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine?
(2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine has a molecular weight of 288.36 g/mol, XLogP of 1.31, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methyl-1,2,4-triazol-3-yl)-4-(2-propan-2-ylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 129338053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).