4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one

C20H24N6O2 — CID 137270730

IUPAC4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one
SMILESCCc1cc(=O)[nH]c(-c2ccc(N3CCOC(C)(c4cnn(C)c4)C3)nc2)n1
InChIInChI=1S/C20H24N6O2/c1-4-16-9-18(27)24-19(23-16)14-5-6-17(21-10-14)26-7-8-28-20(2,13-26)15-11-22-25(3)12-15/h5-6,9-12H,4,7-8,13H2,1-3H3,(H,23,24,27)
InChIKeyHCTYIARUYONDJI-UHFFFAOYSA-N
MW380.45 g/mol
LogP1.88
Rot. Bonds4

About 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one

4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one (PubChem CID 137270730) has the molecular formula C20H24N6O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one
PubChem CID137270730
Molecular FormulaC20H24N6O2
Molecular Weight380.45 g/mol
Exact Mass380.20
IUPAC Name4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one
SMILESCCc1cc(=O)[nH]c(-c2ccc(N3CCOC(C)(c4cnn(C)c4)C3)nc2)n1
InChIInChI=1S/C20H24N6O2/c1-4-16-9-18(27)24-19(23-16)14-5-6-17(21-10-14)26-7-8-28-20(2,13-26)15-11-22-25(3)12-15/h5-6,9-12H,4,7-8,13H2,1-3H3,(H,23,24,27)
InChIKeyHCTYIARUYONDJI-UHFFFAOYSA-N
XLogP1.88
TPSA88.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-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 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one?
The IUPAC name of 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one (CID 137270730) is 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one?
The canonical SMILES for 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one is CCc1cc(=O)[nH]c(-c2ccc(N3CCOC(C)(c4cnn(C)c4)C3)nc2)n1.
What is the InChIKey of 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one?
The InChIKey is HCTYIARUYONDJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O2/c1-4-16-9-18(27)24-19(23-16)14-5-6-17(21-10-14)26-7-8-28-20(2,13-26)15-11-22-25(3)12-15/h5-6,9-12H,4,7-8,13H2,1-3H3,(H,23,24,27).
What are the key properties of 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one?
4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one has a molecular weight of 380.45 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[6-[2-methyl-2-(1-methylpyrazol-4-yl)morpholin-4-yl]-3-pyridinyl]-1H-pyrimidin-6-one is sourced from PubChem (CID 137270730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).