N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide

C11H20N6O — CID 766780

IUPACN-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide
SMILESCCN(CC)c1nc(NC(C)=O)nc(N(C)C)n1
InChIInChI=1S/C11H20N6O/c1-6-17(7-2)11-14-9(12-8(3)18)13-10(15-11)16(4)5/h6-7H2,1-5H3,(H,12,13,14,15,18)
InChIKeySWBYHBHFDBNDIT-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.74
Rot. Bonds5

About N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide

N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide (PubChem CID 766780) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide
PubChem CID766780
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC NameN-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide
SMILESCCN(CC)c1nc(NC(C)=O)nc(N(C)C)n1
InChIInChI=1S/C11H20N6O/c1-6-17(7-2)11-14-9(12-8(3)18)13-10(15-11)16(4)5/h6-7H2,1-5H3,(H,12,13,14,15,18)
InChIKeySWBYHBHFDBNDIT-UHFFFAOYSA-N
XLogP0.74
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide?
The IUPAC name of N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide (CID 766780) is N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide.
What is the SMILES notation for N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide?
The canonical SMILES for N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide is CCN(CC)c1nc(NC(C)=O)nc(N(C)C)n1.
What is the InChIKey of N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide?
The InChIKey is SWBYHBHFDBNDIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-6-17(7-2)11-14-9(12-8(3)18)13-10(15-11)16(4)5/h6-7H2,1-5H3,(H,12,13,14,15,18).
What are the key properties of N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide?
N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide has a molecular weight of 252.32 g/mol, XLogP of 0.74, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]acetamide is sourced from PubChem (CID 766780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).