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

C7H11N5O — CID 57311073

IUPACN-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide
SMILESCC(=O)Nc1ncnc(N(C)C)n1
InChIInChI=1S/C7H11N5O/c1-5(13)10-6-8-4-9-7(11-6)12(2)3/h4H,1-3H3,(H,8,9,10,11,13)
InChIKeyYYTKWJLYWZAXFP-UHFFFAOYSA-N
MW181.20 g/mol
LogP-0.10
Rot. Bonds2

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

N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide (PubChem CID 57311073) has the molecular formula C7H11N5O and a molecular weight of 181.20 g/mol. Its IUPAC name is N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide
PubChem CID57311073
Molecular FormulaC7H11N5O
Molecular Weight181.20 g/mol
Exact Mass181.10
IUPAC NameN-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide
SMILESCC(=O)Nc1ncnc(N(C)C)n1
InChIInChI=1S/C7H11N5O/c1-5(13)10-6-8-4-9-7(11-6)12(2)3/h4H,1-3H3,(H,8,9,10,11,13)
InChIKeyYYTKWJLYWZAXFP-UHFFFAOYSA-N
XLogP-0.10
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide?
The IUPAC name of N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide (CID 57311073) is N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide.
What is the SMILES notation for N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide?
The canonical SMILES for N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide is CC(=O)Nc1ncnc(N(C)C)n1.
What is the InChIKey of N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide?
The InChIKey is YYTKWJLYWZAXFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5O/c1-5(13)10-6-8-4-9-7(11-6)12(2)3/h4H,1-3H3,(H,8,9,10,11,13).
What are the key properties of N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide?
N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide has a molecular weight of 181.20 g/mol, XLogP of -0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)-1,3,5-triazin-2-yl]acetamide is sourced from PubChem (CID 57311073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).