N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide

C12H20N6O2 — CID 80821439

IUPACN-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide
SMILESCCNc1nc(OC)nc(N(C)CC(=O)NC2CC2)n1
InChIInChI=1S/C12H20N6O2/c1-4-13-10-15-11(17-12(16-10)20-3)18(2)7-9(19)14-8-5-6-8/h8H,4-7H2,1-3H3,(H,14,19)(H,13,15,16,17)
InChIKeyCGQNUPPBAZBMCZ-UHFFFAOYSA-N
MW280.33 g/mol
LogP0.03
Rot. Bonds7

About N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide

N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide (PubChem CID 80821439) has the molecular formula C12H20N6O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide
PubChem CID80821439
Molecular FormulaC12H20N6O2
Molecular Weight280.33 g/mol
Exact Mass280.16
IUPAC NameN-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide
SMILESCCNc1nc(OC)nc(N(C)CC(=O)NC2CC2)n1
InChIInChI=1S/C12H20N6O2/c1-4-13-10-15-11(17-12(16-10)20-3)18(2)7-9(19)14-8-5-6-8/h8H,4-7H2,1-3H3,(H,14,19)(H,13,15,16,17)
InChIKeyCGQNUPPBAZBMCZ-UHFFFAOYSA-N
XLogP0.03
TPSA92.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[[4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]-methylamino]-N-cyclopropylacetamide
CID 80820490
N-cyclopropyl-2-[[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-methylamino]acetamide
CID 80820491
2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]ethanol
CID 80771509
2-[[4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]-methylamino]-N-methylacetamide
CID 80780722
N-cyclopropyl-2-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80934592
2-[(5-aminopyrimidin-2-yl)-methylamino]-N-cyclopropylacetamide
CID 61145458
N-cyclopropyl-2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]-methylamino]acetamide
CID 80941047
2-[[4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]-methylamino]-N-propylacetamide
CID 80808415
N-cyclopropyl-2-[methoxy(methyl)amino]acetamide
CID 131224480
2-N-(3,3-dimethylbutan-2-yl)-4-N-ethyl-6-methoxy-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 80815170
4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80773721
2-N,2-N-dibutyl-4-N-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 80753763

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide (CID 80821439) is N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide is CCNc1nc(OC)nc(N(C)CC(=O)NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide?
The InChIKey is CGQNUPPBAZBMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N6O2/c1-4-13-10-15-11(17-12(16-10)20-3)18(2)7-9(19)14-8-5-6-8/h8H,4-7H2,1-3H3,(H,14,19)(H,13,15,16,17).
What are the key properties of N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide?
N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide has a molecular weight of 280.33 g/mol, XLogP of 0.03, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]acetamide is sourced from PubChem (CID 80821439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).