4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide

C13H23N5O2 — CID 4260974

IUPAC4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide
SMILESCCCCN(CCCC)c1nc(OC)nc(C(N)=O)n1
InChIInChI=1S/C13H23N5O2/c1-4-6-8-18(9-7-5-2)12-15-11(10(14)19)16-13(17-12)20-3/h4-9H2,1-3H3,(H2,14,19)
InChIKeyLGLIOEKKLJNNDX-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.39
Rot. Bonds9

About 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide

4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide (PubChem CID 4260974) has the molecular formula C13H23N5O2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide.

Molecular Properties

Compound Name4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide
PubChem CID4260974
Molecular FormulaC13H23N5O2
Molecular Weight281.36 g/mol
Exact Mass281.19
IUPAC Name4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide
SMILESCCCCN(CCCC)c1nc(OC)nc(C(N)=O)n1
InChIInChI=1S/C13H23N5O2/c1-4-6-8-18(9-7-5-2)12-15-11(10(14)19)16-13(17-12)20-3/h4-9H2,1-3H3,(H2,14,19)
InChIKeyLGLIOEKKLJNNDX-UHFFFAOYSA-N
XLogP1.39
TPSA94.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(Dimethylamino)-6-(4-morpholinyl)-1,3,5-triazine-2-carboxamide
CID 942832
4,6-Bis(dimethylamino)-1,3,5-triazine-2-carboxamide
CID 910049
2-[(4-amino-6-tert-butyl-1,3,5-triazin-2-yl)-methylamino]-N,N-diethylacetamide
CID 132312840
2-[[4-(Dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-ethylamino]acetamide
CID 132381777
4-Methoxy-6-piperidin-1-yl-[1,3,5]triazine-2-carboxylic acid amide
CID 729324
4-(Diethylamino)-6-methoxy-1,3,5-triazine-2-carboxamide
CID 4355148
4-Ethoxy-6-piperidin-1-yl-[1,3,5]triazine-2-carboxylic acid amide
CID 4417775
2-Amino-4-carbamoyl-6-piperidino-1,3,5-triazine
CID 601007
[1,3,5]Triazine-2-carboxylic acid, 4-ethylamino-6-piperidin-1-yl-, amide
CID 672103
2,4,6-Tri(butylcarbamoyl)-1,3,5-triazine
CID 12040478
N,N-dibutyl-1,3,5-triazine-2-carboxamide
CID 118936402
2-N,4-N,6-N-tributyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-tricarboxamide
CID 118936663

Frequently Asked Questions

What is the IUPAC name of 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide?
The IUPAC name of 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide (CID 4260974) is 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide.
What is the SMILES notation for 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide?
The canonical SMILES for 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide is CCCCN(CCCC)c1nc(OC)nc(C(N)=O)n1.
What is the InChIKey of 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide?
The InChIKey is LGLIOEKKLJNNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O2/c1-4-6-8-18(9-7-5-2)12-15-11(10(14)19)16-13(17-12)20-3/h4-9H2,1-3H3,(H2,14,19).
What are the key properties of 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide?
4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 1.39, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dibutylamino)-6-methoxy-1,3,5-triazine-2-carboxamide is sourced from PubChem (CID 4260974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).