2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine

C5H10N6O3 — CID 159375275

IUPAC2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine
SMILESNc1nc(N)nc(N)n1.O=C(O)CO
InChIInChI=1S/C3H6N6.C2H4O3/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5/h(H6,4,5,6,7,8,9);3H,1H2,(H,4,5)
InChIKeyLKFSDOJNZJNIKZ-UHFFFAOYSA-N
MW202.17 g/mol
LogP-2.32
Rot. Bonds1

About 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine

2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine (PubChem CID 159375275) has the molecular formula C5H10N6O3 and a molecular weight of 202.17 g/mol. Its IUPAC name is 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine
PubChem CID159375275
Molecular FormulaC5H10N6O3
Molecular Weight202.17 g/mol
Exact Mass202.08
IUPAC Name2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine
SMILESNc1nc(N)nc(N)n1.O=C(O)CO
InChIInChI=1S/C3H6N6.C2H4O3/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5/h(H6,4,5,6,7,8,9);3H,1H2,(H,4,5)
InChIKeyLKFSDOJNZJNIKZ-UHFFFAOYSA-N
XLogP-2.32
TPSA174.26 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.17
LogP ≤ 5-2.32
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine (CID 159375275) is 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine is Nc1nc(N)nc(N)n1.O=C(O)CO.
What is the InChIKey of 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine?
The InChIKey is LKFSDOJNZJNIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N6.C2H4O3/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5/h(H6,4,5,6,7,8,9);3H,1H2,(H,4,5).
What are the key properties of 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine?
2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine has a molecular weight of 202.17 g/mol, XLogP of -2.32, 1 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyacetic acid;1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 159375275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).