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

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Related Compounds

ethyl 3-(4-morpholin-4-yl-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-oxopropanoate
CID 5260903
4-(5-bromo-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)morpholine
CID 129255881
4-(4-pyridin-2-yl-1,3,5-triazin-2-yl)morpholine
CID 141107060
ethyl 4-methyl-6-morpholin-4-yl-2-pyridin-3-ylpyrimidine-5-carboxylate
CID 139881750
(5-methyl-6-morpholin-4-yl-3-pyridinyl)-phenylmethanone
CID 102544847
6-methoxy-1-(4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidin-5-yl)hexan-1-one
CID 159327659
(5-morpholin-4-yl-4-pyridin-2-ylthiophen-2-yl)-phenylmethanone
CID 1485941
(2-methyl-6-morpholin-4-yl-3-pyridinyl)-phenylmethanone
CID 102546248
4-(5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-yl)-2-(4-fluorophenyl)morpholine
CID 133290851
4,6-dimethyl-2-(2-methylpyrimidin-4-yl)pyrimidine-5-carboxylic acid
CID 113329643
6-methyl-2-morpholin-4-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidine-4-carboxamide
CID 46978556
4-[6-(phenoxymethyl)-2-pyridin-2-ylpyrimidin-4-yl]morpholine
CID 58137077

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).