4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid

C10H15N5O3 — CID 1088145

IUPAC4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid
SMILESCCNc1nc(C(=O)O)nc(N2CCOCC2)n1
InChIInChI=1S/C10H15N5O3/c1-2-11-9-12-7(8(16)17)13-10(14-9)15-3-5-18-6-4-15/h2-6H2,1H3,(H,16,17)(H,11,12,13,14)
InChIKeyCVTXDUNENNGTKI-UHFFFAOYSA-N
MW253.26 g/mol
LogP-0.16
Rot. Bonds4

About 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid

4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid (PubChem CID 1088145) has the molecular formula C10H15N5O3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid.

Molecular Properties

Compound Name4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid
PubChem CID1088145
Molecular FormulaC10H15N5O3
Molecular Weight253.26 g/mol
Exact Mass253.12
IUPAC Name4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid
SMILESCCNc1nc(C(=O)O)nc(N2CCOCC2)n1
InChIInChI=1S/C10H15N5O3/c1-2-11-9-12-7(8(16)17)13-10(14-9)15-3-5-18-6-4-15/h2-6H2,1H3,(H,16,17)(H,11,12,13,14)
InChIKeyCVTXDUNENNGTKI-UHFFFAOYSA-N
XLogP-0.16
TPSA100.47 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

4-(Dimethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid
CID 943313
4-Methylamino-6-morpholin-4-yl-[1,3,5]triazine-2-carboxylic acid
CID 1992041
Ethyl 2-[(4-cyano-6-morpholino-1,3,5-triazin-2-yl)amino]acetate
CID 712287
2-Hydroxyethyl 4,6-bis(ethylamino)-1,3,5-triazine-2-carboxylate
CID 4166805
4,6-Di-morpholin-4-yl-[1,3,5]triazine-2-carboxylic acid
CID 1288587
Ethanol, 2-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-, acetate (ester)
CID 3080158
Ethyl 4-methyl-6-(propan-2-ylamino)-1,3,5-triazine-2-carboxylate
CID 76331065
Bas 07119533
CID 934204
4,6-Bis(ethylamino)-1,3,5-triazine-2-carboxylic acid
CID 597486
Ethyl 4-methyl-6-(prop-2-ynylamino)-1,3,5-triazine-2-carboxylate
CID 76309242
Ethyl 4-(butylamino)-6-methyl-1,3,5-triazine-2-carboxylate
CID 76316487
Ethyl 4-methyl-6-(propylamino)-1,3,5-triazine-2-carboxylate
CID 76320173

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid?
The IUPAC name of 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid (CID 1088145) is 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid.
What is the SMILES notation for 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid?
The canonical SMILES for 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid is CCNc1nc(C(=O)O)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid?
The InChIKey is CVTXDUNENNGTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O3/c1-2-11-9-12-7(8(16)17)13-10(14-9)15-3-5-18-6-4-15/h2-6H2,1H3,(H,16,17)(H,11,12,13,14).
What are the key properties of 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid?
4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid has a molecular weight of 253.26 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid is sourced from PubChem (CID 1088145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).