(2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid

C6H9N3O2 — CID 26597297

IUPAC(2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid
SMILESCn1ccnc1[C@@H](N)C(=O)O
InChIInChI=1S/C6H9N3O2/c1-9-3-2-8-5(9)4(7)6(10)11/h2-4H,7H2,1H3,(H,10,11)/t4-/m1/s1
InChIKeyGPZQLERXSNGJLV-SCSAIBSYSA-N
MW155.16 g/mol
LogP-0.50
Rot. Bonds2

About (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid

(2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid (PubChem CID 26597297) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid.

Molecular Properties

Compound Name(2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid
PubChem CID26597297
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name(2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid
SMILESCn1ccnc1[C@@H](N)C(=O)O
InChIInChI=1S/C6H9N3O2/c1-9-3-2-8-5(9)4(7)6(10)11/h2-4H,7H2,1H3,(H,10,11)/t4-/m1/s1
InChIKeyGPZQLERXSNGJLV-SCSAIBSYSA-N
XLogP-0.50
TPSA81.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-amino-2-(1-methylimidazol-2-yl)acetate;hydrochloride
CID 44891077
(2R)-2-methoxy-2-(1-methylimidazol-2-yl)acetic acid
CID 167014806
(1R)-1-(1-methylimidazol-2-yl)ethanamine
CID 42220137
(1S)-1-(1-methylimidazol-2-yl)ethanamine;dihydrochloride
CID 162341662
methyl (3R)-3-amino-3-(1-methylimidazol-2-yl)propanoate
CID 165494326
1-(1-methylimidazol-2-yl)propane-1-thiol
CID 174522847
sodium 2-hydroxy-2-(1-methylimidazol-2-yl)acetate
CID 167726332
methane;1-(1-methylimidazol-2-yl)ethanol
CID 174578222
2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetic acid
CID 130490759
3-ethyl-1-(1-methylimidazol-2-yl)pentan-1-amine
CID 82922287
1-(1-methylimidazol-2-yl)propan-1-amine;nitric acid
CID 172745142
bis(1-methylimidazol-2-yl)methylhydrazine
CID 105258117

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid?
The IUPAC name of (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid (CID 26597297) is (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid.
What is the SMILES notation for (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid?
The canonical SMILES for (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid is Cn1ccnc1[C@@H](N)C(=O)O.
What is the InChIKey of (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid?
The InChIKey is GPZQLERXSNGJLV-SCSAIBSYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-9-3-2-8-5(9)4(7)6(10)11/h2-4H,7H2,1H3,(H,10,11)/t4-/m1/s1.
What are the key properties of (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid?
(2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid has a molecular weight of 155.16 g/mol, XLogP of -0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid is sourced from PubChem (CID 26597297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).