4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid

C15H16N4O3 — CID 139881756

IUPAC4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid
SMILESCc1nc(-c2ccccn2)nc(N2CCOCC2)c1C(=O)O
InChIInChI=1S/C15H16N4O3/c1-10-12(15(20)21)14(19-6-8-22-9-7-19)18-13(17-10)11-4-2-3-5-16-11/h2-5H,6-9H2,1H3,(H,20,21)
InChIKeyMXVHCYOUCXZKIA-UHFFFAOYSA-N
MW300.32 g/mol
LogP1.38
Rot. Bonds3

About 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid

4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid (PubChem CID 139881756) has the molecular formula C15H16N4O3 and a molecular weight of 300.32 g/mol. Its IUPAC name is 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid.

Molecular Properties

Compound Name4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid
PubChem CID139881756
Molecular FormulaC15H16N4O3
Molecular Weight300.32 g/mol
Exact Mass300.12
IUPAC Name4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid
SMILESCc1nc(-c2ccccn2)nc(N2CCOCC2)c1C(=O)O
InChIInChI=1S/C15H16N4O3/c1-10-12(15(20)21)14(19-6-8-22-9-7-19)18-13(17-10)11-4-2-3-5-16-11/h2-5H,6-9H2,1H3,(H,20,21)
InChIKeyMXVHCYOUCXZKIA-UHFFFAOYSA-N
XLogP1.38
TPSA88.44 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid 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-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid?
The IUPAC name of 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid (CID 139881756) is 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid.
What is the SMILES notation for 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid?
The canonical SMILES for 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid is Cc1nc(-c2ccccn2)nc(N2CCOCC2)c1C(=O)O.
What is the InChIKey of 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid?
The InChIKey is MXVHCYOUCXZKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O3/c1-10-12(15(20)21)14(19-6-8-22-9-7-19)18-13(17-10)11-4-2-3-5-16-11/h2-5H,6-9H2,1H3,(H,20,21).
What are the key properties of 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid?
4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid has a molecular weight of 300.32 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid is sourced from PubChem (CID 139881756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).