2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine

C6H15N7O2 — CID 160651743

IUPAC2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine
SMILESC=O.NCCO.Nc1nc(N)nc(N)n1
InChIInChI=1S/C3H6N6.C2H7NO.CH2O/c4-1-7-2(5)9-3(6)8-1;3-1-2-4;1-2/h(H6,4,5,6,7,8,9);4H,1-3H2;1H2
InChIKeyRKNAKWQMNGLVKT-UHFFFAOYSA-N
MW217.23 g/mol
LogP-2.63
Rot. Bonds1

About 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine

2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine (PubChem CID 160651743) has the molecular formula C6H15N7O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine
PubChem CID160651743
Molecular FormulaC6H15N7O2
Molecular Weight217.23 g/mol
Exact Mass217.13
IUPAC Name2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine
SMILESC=O.NCCO.Nc1nc(N)nc(N)n1
InChIInChI=1S/C3H6N6.C2H7NO.CH2O/c4-1-7-2(5)9-3(6)8-1;3-1-2-4;1-2/h(H6,4,5,6,7,8,9);4H,1-3H2;1H2
InChIKeyRKNAKWQMNGLVKT-UHFFFAOYSA-N
XLogP-2.63
TPSA180.05 Ų
H-Bond Donors5
H-Bond Acceptors9
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 5-2.63
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine (CID 160651743) is 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine is C=O.NCCO.Nc1nc(N)nc(N)n1.
What is the InChIKey of 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine?
The InChIKey is RKNAKWQMNGLVKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N6.C2H7NO.CH2O/c4-1-7-2(5)9-3(6)8-1;3-1-2-4;1-2/h(H6,4,5,6,7,8,9);4H,1-3H2;1H2.
What are the key properties of 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine?
2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine has a molecular weight of 217.23 g/mol, XLogP of -2.63, 1 rotatable bonds, 5 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethanol;formaldehyde;1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 160651743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).