2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide

C7H12N6O — CID 130532629

IUPAC2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide
SMILESCCc1nc(N)nc(NCC(N)=O)n1
InChIInChI=1S/C7H12N6O/c1-2-5-11-6(9)13-7(12-5)10-3-4(8)14/h2-3H2,1H3,(H2,8,14)(H3,9,10,11,12,13)
InChIKeyLVTVVYYNMUNFKM-UHFFFAOYSA-N
MW196.21 g/mol
LogP-1.09
Rot. Bonds4

About 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide

2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide (PubChem CID 130532629) has the molecular formula C7H12N6O and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide.

Molecular Properties

Compound Name2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide
PubChem CID130532629
Molecular FormulaC7H12N6O
Molecular Weight196.21 g/mol
Exact Mass196.11
IUPAC Name2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide
SMILESCCc1nc(N)nc(NCC(N)=O)n1
InChIInChI=1S/C7H12N6O/c1-2-5-11-6(9)13-7(12-5)10-3-4(8)14/h2-3H2,1H3,(H2,8,14)(H3,9,10,11,12,13)
InChIKeyLVTVVYYNMUNFKM-UHFFFAOYSA-N
XLogP-1.09
TPSA119.81 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-1.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide?
The IUPAC name of 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide (CID 130532629) is 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide.
What is the SMILES notation for 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide?
The canonical SMILES for 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide is CCc1nc(N)nc(NCC(N)=O)n1.
What is the InChIKey of 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide?
The InChIKey is LVTVVYYNMUNFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N6O/c1-2-5-11-6(9)13-7(12-5)10-3-4(8)14/h2-3H2,1H3,(H2,8,14)(H3,9,10,11,12,13).
What are the key properties of 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide?
2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide has a molecular weight of 196.21 g/mol, XLogP of -1.09, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-6-ethyl-1,3,5-triazin-2-yl)amino]acetamide is sourced from PubChem (CID 130532629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).