4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide

C14H23N5O2 — CID 83105672

IUPAC4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide
SMILESCCNc1ncnc(N2CCOCC2C(=O)NC)c1CC
InChIInChI=1S/C14H23N5O2/c1-4-10-12(16-5-2)17-9-18-13(10)19-6-7-21-8-11(19)14(20)15-3/h9,11H,4-8H2,1-3H3,(H,15,20)(H,16,17,18)
InChIKeyAZXOQSYUWPWQBJ-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.42
Rot. Bonds5

About 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide

4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide (PubChem CID 83105672) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide
PubChem CID83105672
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide
SMILESCCNc1ncnc(N2CCOCC2C(=O)NC)c1CC
InChIInChI=1S/C14H23N5O2/c1-4-10-12(16-5-2)17-9-18-13(10)19-6-7-21-8-11(19)14(20)15-3/h9,11H,4-8H2,1-3H3,(H,15,20)(H,16,17,18)
InChIKeyAZXOQSYUWPWQBJ-UHFFFAOYSA-N
XLogP0.42
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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-methyl-4-[5-methyl-6-(propylamino)pyrimidin-4-yl]morpholine-3-carboxamide
CID 83105081
N-ethyl-4-[6-(ethylamino)-5-methylpyrimidin-4-yl]morpholine-3-carboxamide
CID 83105968
N-methyl-4-[5-methyl-6-(methylamino)pyrimidin-4-yl]morpholine-3-carboxamide
CID 83103916
4-(6-amino-5-ethylpyrimidin-4-yl)-N-ethylmorpholine-3-carboxamide
CID 83105787
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
5-ethyl-N-methyl-6-(3-methylmorpholin-4-yl)pyrimidin-4-amine
CID 80780914
1-[6-(ethylamino)-5-propylpyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80785994
1-[5-ethyl-6-(propylamino)pyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80785472
4-[6-(ethylamino)-5-propan-2-ylpyrimidin-4-yl]morpholine-3-carboxamide
CID 83099249

Frequently Asked Questions

What is the IUPAC name of 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide?
The IUPAC name of 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide (CID 83105672) is 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide?
The canonical SMILES for 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide is CCNc1ncnc(N2CCOCC2C(=O)NC)c1CC.
What is the InChIKey of 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide?
The InChIKey is AZXOQSYUWPWQBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-4-10-12(16-5-2)17-9-18-13(10)19-6-7-21-8-11(19)14(20)15-3/h9,11H,4-8H2,1-3H3,(H,15,20)(H,16,17,18).
What are the key properties of 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide?
4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.42, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-N-methylmorpholine-3-carboxamide is sourced from PubChem (CID 83105672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).