2-aminoacetic acid;2-methyl-1H-imidazole

C6H11N3O2 — CID 126510094

IUPAC2-aminoacetic acid;2-methyl-1H-imidazole
SMILESCc1ncc[nH]1.NCC(=O)O
InChIInChI=1S/C4H6N2.C2H5NO2/c1-4-5-2-3-6-4;3-1-2(4)5/h2-3H,1H3,(H,5,6);1,3H2,(H,4,5)
InChIKeyPNAHAOZKYDWOOH-UHFFFAOYSA-N
MW157.17 g/mol
LogP-0.25
Rot. Bonds1

About 2-aminoacetic acid;2-methyl-1H-imidazole

2-aminoacetic acid;2-methyl-1H-imidazole (PubChem CID 126510094) has the molecular formula C6H11N3O2 and a molecular weight of 157.17 g/mol. Its IUPAC name is 2-aminoacetic acid;2-methyl-1H-imidazole.

Molecular Properties

Compound Name2-aminoacetic acid;2-methyl-1H-imidazole
PubChem CID126510094
Molecular FormulaC6H11N3O2
Molecular Weight157.17 g/mol
Exact Mass157.09
IUPAC Name2-aminoacetic acid;2-methyl-1H-imidazole
SMILESCc1ncc[nH]1.NCC(=O)O
InChIInChI=1S/C4H6N2.C2H5NO2/c1-4-5-2-3-6-4;3-1-2(4)5/h2-3H,1H3,(H,5,6);1,3H2,(H,4,5)
InChIKeyPNAHAOZKYDWOOH-UHFFFAOYSA-N
XLogP-0.25
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;2-methyl-1H-imidazole?
The IUPAC name of 2-aminoacetic acid;2-methyl-1H-imidazole (CID 126510094) is 2-aminoacetic acid;2-methyl-1H-imidazole.
What is the SMILES notation for 2-aminoacetic acid;2-methyl-1H-imidazole?
The canonical SMILES for 2-aminoacetic acid;2-methyl-1H-imidazole is Cc1ncc[nH]1.NCC(=O)O.
What is the InChIKey of 2-aminoacetic acid;2-methyl-1H-imidazole?
The InChIKey is PNAHAOZKYDWOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2.C2H5NO2/c1-4-5-2-3-6-4;3-1-2(4)5/h2-3H,1H3,(H,5,6);1,3H2,(H,4,5).
What are the key properties of 2-aminoacetic acid;2-methyl-1H-imidazole?
2-aminoacetic acid;2-methyl-1H-imidazole has a molecular weight of 157.17 g/mol, XLogP of -0.25, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;2-methyl-1H-imidazole is sourced from PubChem (CID 126510094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).