N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide

C12H19N5O2 — CID 83103916

IUPACN-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1c1ncnc(NC)c1C
InChIInChI=1S/C12H19N5O2/c1-8-10(13-2)15-7-16-11(8)17-4-5-19-6-9(17)12(18)14-3/h7,9H,4-6H2,1-3H3,(H,14,18)(H,13,15,16)
InChIKeyJJAPOFREESTECU-UHFFFAOYSA-N
MW265.32 g/mol
LogP-0.22
Rot. Bonds3

About N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide

N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide (PubChem CID 83103916) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide
PubChem CID83103916
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC NameN-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1c1ncnc(NC)c1C
InChIInChI=1S/C12H19N5O2/c1-8-10(13-2)15-7-16-11(8)17-4-5-19-6-9(17)12(18)14-3/h7,9H,4-6H2,1-3H3,(H,14,18)(H,13,15,16)
InChIKeyJJAPOFREESTECU-UHFFFAOYSA-N
XLogP-0.22
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(6-hydrazinyl-5-methylpyrimidin-4-yl)-N-methylmorpholine-3-carboxamide
CID 83104519
N-ethyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide
CID 83104234
N-methyl-4-[5-methyl-6-(propylamino)pyrimidin-4-yl]morpholine-3-carboxamide
CID 83105081
4-[5-ethyl-6-(methylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide
CID 83104376
N-methyl-4-[6-(methylamino)-5-propylpyrimidin-4-yl]morpholine-3-carboxamide
CID 83105245
N-ethyl-4-[6-(ethylamino)-5-methylpyrimidin-4-yl]morpholine-3-carboxamide
CID 83105968
4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide
CID 83105672
4-[3-(methylcarbamoyl)morpholin-4-yl]pyrimidine-5-carboxylic acid
CID 114214594
N-ethyl-4-[5-methoxy-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide
CID 83104938
4-(3-cyano-4-methyl-2-pyridinyl)-N-methylmorpholine-3-carboxamide
CID 83099052
N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide
CID 80786025
4-(6-amino-3-pyridinyl)-N-methylmorpholine-3-carboxamide
CID 83106485

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide?
The IUPAC name of N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide (CID 83103916) is N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide.
What is the SMILES notation for N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide?
The canonical SMILES for N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide is CNC(=O)C1COCCN1c1ncnc(NC)c1C.
What is the InChIKey of N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide?
The InChIKey is JJAPOFREESTECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-8-10(13-2)15-7-16-11(8)17-4-5-19-6-9(17)12(18)14-3/h7,9H,4-6H2,1-3H3,(H,14,18)(H,13,15,16).
What are the key properties of N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide?
N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide has a molecular weight of 265.32 g/mol, XLogP of -0.22, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide is sourced from PubChem (CID 83103916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).