2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide

C10H18N6O2 — CID 80809168

IUPAC2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide
SMILESCCN(CC(=O)NC)c1nc(NC)nc(OC)n1
InChIInChI=1S/C10H18N6O2/c1-5-16(6-7(17)11-2)9-13-8(12-3)14-10(15-9)18-4/h5-6H2,1-4H3,(H,11,17)(H,12,13,14,15)
InChIKeyABUBFDUYXNVOAI-UHFFFAOYSA-N
MW254.29 g/mol
LogP-0.51
Rot. Bonds6

About 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide

2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide (PubChem CID 80809168) has the molecular formula C10H18N6O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide
PubChem CID80809168
Molecular FormulaC10H18N6O2
Molecular Weight254.29 g/mol
Exact Mass254.15
IUPAC Name2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide
SMILESCCN(CC(=O)NC)c1nc(NC)nc(OC)n1
InChIInChI=1S/C10H18N6O2/c1-5-16(6-7(17)11-2)9-13-8(12-3)14-10(15-9)18-4/h5-6H2,1-4H3,(H,11,17)(H,12,13,14,15)
InChIKeyABUBFDUYXNVOAI-UHFFFAOYSA-N
XLogP-0.51
TPSA92.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[ethyl-[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide
CID 80808988
2-[(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)-propylamino]-N-methylacetamide
CID 80904852
N-ethyl-2-[ethyl-[4-(methylamino)-6-propoxy-1,3,5-triazin-2-yl]amino]acetamide
CID 80785605
2-[[4-(diethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-ethylamino]-N-methylacetamide
CID 80900599
3-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropanenitrile
CID 80806832
2-[[4-(diethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide
CID 80783182
2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-ethylamino]-N-ethylacetamide
CID 62858007
3-[[4-(diethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]oxy]propan-1-ol
CID 80867459
2-N,2-N-diethyl-4-N-methyl-6-[(2-methylpropan-2-yl)oxy]-1,3,5-triazine-2,4-diamine
CID 80862256
2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-ethylamino]acetamide
CID 103103708
2-[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]-propan-2-ylamino]acetamide
CID 80805678
2-[[4-ethoxy-6-(ethylamino)-1,3,5-triazin-2-yl]-propylamino]-N-methylacetamide
CID 80785634

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide?
The IUPAC name of 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide (CID 80809168) is 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide.
What is the SMILES notation for 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide?
The canonical SMILES for 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide is CCN(CC(=O)NC)c1nc(NC)nc(OC)n1.
What is the InChIKey of 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide?
The InChIKey is ABUBFDUYXNVOAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6O2/c1-5-16(6-7(17)11-2)9-13-8(12-3)14-10(15-9)18-4/h5-6H2,1-4H3,(H,11,17)(H,12,13,14,15).
What are the key properties of 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide?
2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide has a molecular weight of 254.29 g/mol, XLogP of -0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-N-methylacetamide is sourced from PubChem (CID 80809168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).