4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide

C14H22N4O2 — CID 110254121

IUPAC4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide
SMILESCc1cc(C)nc(N2CCOC(C)(C(=O)N(C)C)C2)n1
InChIInChI=1S/C14H22N4O2/c1-10-8-11(2)16-13(15-10)18-6-7-20-14(3,9-18)12(19)17(4)5/h8H,6-7,9H2,1-5H3
InChIKeyXJOHTHLKVMRWJR-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.78
Rot. Bonds2

About 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide

4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide (PubChem CID 110254121) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide.

Molecular Properties

Compound Name4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide
PubChem CID110254121
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide
SMILESCc1cc(C)nc(N2CCOC(C)(C(=O)N(C)C)C2)n1
InChIInChI=1S/C14H22N4O2/c1-10-8-11(2)16-13(15-10)18-6-7-20-14(3,9-18)12(19)17(4)5/h8H,6-7,9H2,1-5H3
InChIKeyXJOHTHLKVMRWJR-UHFFFAOYSA-N
XLogP0.78
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide 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-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide?
The IUPAC name of 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide (CID 110254121) is 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide.
What is the SMILES notation for 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide?
The canonical SMILES for 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide is Cc1cc(C)nc(N2CCOC(C)(C(=O)N(C)C)C2)n1.
What is the InChIKey of 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide?
The InChIKey is XJOHTHLKVMRWJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-10-8-11(2)16-13(15-10)18-6-7-20-14(3,9-18)12(19)17(4)5/h8H,6-7,9H2,1-5H3.
What are the key properties of 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide?
4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 0.78, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,6-dimethylpyrimidin-2-yl)-N,N,2-trimethylmorpholine-2-carboxamide is sourced from PubChem (CID 110254121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).