2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide

C8H11N5O — CID 63867148

IUPAC2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide
SMILESNC(=O)Cc1nc(N)nc(C2CC2)n1
InChIInChI=1S/C8H11N5O/c9-5(14)3-6-11-7(4-1-2-4)13-8(10)12-6/h4H,1-3H2,(H2,9,14)(H2,10,11,12,13)
InChIKeyCQOAYZHCZFMHPP-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.64
Rot. Bonds3

About 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide

2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide (PubChem CID 63867148) has the molecular formula C8H11N5O and a molecular weight of 193.21 g/mol. Its IUPAC name is 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide
PubChem CID63867148
Molecular FormulaC8H11N5O
Molecular Weight193.21 g/mol
Exact Mass193.10
IUPAC Name2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide
SMILESNC(=O)Cc1nc(N)nc(C2CC2)n1
InChIInChI=1S/C8H11N5O/c9-5(14)3-6-11-7(4-1-2-4)13-8(10)12-6/h4H,1-3H2,(H2,9,14)(H2,10,11,12,13)
InChIKeyCQOAYZHCZFMHPP-UHFFFAOYSA-N
XLogP-0.64
TPSA107.78 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide?
The IUPAC name of 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide (CID 63867148) is 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide.
What is the SMILES notation for 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide?
The canonical SMILES for 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide is NC(=O)Cc1nc(N)nc(C2CC2)n1.
What is the InChIKey of 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide?
The InChIKey is CQOAYZHCZFMHPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O/c9-5(14)3-6-11-7(4-1-2-4)13-8(10)12-6/h4H,1-3H2,(H2,9,14)(H2,10,11,12,13).
What are the key properties of 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide?
2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide has a molecular weight of 193.21 g/mol, XLogP of -0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6-cyclopropyl-1,3,5-triazin-2-yl)acetamide is sourced from PubChem (CID 63867148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).