2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide

C14H22N4O2 — CID 47256757

IUPAC2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide
SMILESCc1nccc(C(=O)NCC(C)(C)N2CCOCC2)n1
InChIInChI=1S/C14H22N4O2/c1-11-15-5-4-12(17-11)13(19)16-10-14(2,3)18-6-8-20-9-7-18/h4-5H,6-10H2,1-3H3,(H,16,19)
InChIKeyUXWBBJFVZJZAML-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.63
Rot. Bonds4

About 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide

2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide (PubChem CID 47256757) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide
PubChem CID47256757
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide
SMILESCc1nccc(C(=O)NCC(C)(C)N2CCOCC2)n1
InChIInChI=1S/C14H22N4O2/c1-11-15-5-4-12(17-11)13(19)16-10-14(2,3)18-6-8-20-9-7-18/h4-5H,6-10H2,1-3H3,(H,16,19)
InChIKeyUXWBBJFVZJZAML-UHFFFAOYSA-N
XLogP0.63
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-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 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide (CID 47256757) is 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide is Cc1nccc(C(=O)NCC(C)(C)N2CCOCC2)n1.
What is the InChIKey of 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide?
The InChIKey is UXWBBJFVZJZAML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-11-15-5-4-12(17-11)13(19)16-10-14(2,3)18-6-8-20-9-7-18/h4-5H,6-10H2,1-3H3,(H,16,19).
What are the key properties of 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide?
2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 0.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 47256757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).