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

C5H11N7O2 — CID 19091153

IUPAC2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine
SMILESNCC(=O)O.Nc1nc(N)nc(N)n1
InChIInChI=1S/C3H6N6.C2H5NO2/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5/h(H6,4,5,6,7,8,9);1,3H2,(H,4,5)
InChIKeyQRLWGMUQKUWYAE-UHFFFAOYSA-N
MW201.19 g/mol
LogP-2.35
Rot. Bonds1

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

2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine (PubChem CID 19091153) has the molecular formula C5H11N7O2 and a molecular weight of 201.19 g/mol. Its IUPAC name is 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine
PubChem CID19091153
Molecular FormulaC5H11N7O2
Molecular Weight201.19 g/mol
Exact Mass201.10
IUPAC Name2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine
SMILESNCC(=O)O.Nc1nc(N)nc(N)n1
InChIInChI=1S/C3H6N6.C2H5NO2/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5/h(H6,4,5,6,7,8,9);1,3H2,(H,4,5)
InChIKeyQRLWGMUQKUWYAE-UHFFFAOYSA-N
XLogP-2.35
TPSA180.05 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 5-2.35
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

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Related Compounds

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1,3,5-Triazine-2,4,6-triyltrisglycine
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2-[[4-(Dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]acetic acid
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CID 19091154
2-[(4,6-Diamino-1,3,5-triazin-2-yl)amino]acetic acid
CID 53847074
2-[[4-Amino-6-(carboxymethylamino)-1,3,5-triazin-2-yl]amino]acetic acid
CID 67194114
2-[[4-(Carboxymethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]acetic acid
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2-Aminoacetic acid;formaldehyde;1,3,5-triazine-2,4,6-triamine
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2-Aminoacetic acid;1,3,5-triazine
CID 159767782
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Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine (CID 19091153) is 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine is NCC(=O)O.Nc1nc(N)nc(N)n1.
What is the InChIKey of 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine?
The InChIKey is QRLWGMUQKUWYAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N6.C2H5NO2/c4-1-7-2(5)9-3(6)8-1;3-1-2(4)5/h(H6,4,5,6,7,8,9);1,3H2,(H,4,5).
What are the key properties of 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine?
2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine has a molecular weight of 201.19 g/mol, XLogP of -2.35, 1 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 19091153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).