2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum

C6H9MoN3O2 — CID 174573236

IUPAC2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum
SMILESNC(Cc1cnc[nH]1)C(=O)O.[Mo]
InChIInChI=1S/C6H9N3O2.Mo/c7-5(6(10)11)1-4-2-8-3-9-4;/h2-3,5H,1,7H2,(H,8,9)(H,10,11);
InChIKeyUMFIYMCYLXYBTK-UHFFFAOYSA-N
MW251.10 g/mol
LogP-0.64
Rot. Bonds3

About 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum

2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum (PubChem CID 174573236) has the molecular formula C6H9MoN3O2 and a molecular weight of 251.10 g/mol. Its IUPAC name is 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum.

Molecular Properties

Compound Name2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum
PubChem CID174573236
Molecular FormulaC6H9MoN3O2
Molecular Weight251.10 g/mol
Exact Mass252.97
IUPAC Name2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum
SMILESNC(Cc1cnc[nH]1)C(=O)O.[Mo]
InChIInChI=1S/C6H9N3O2.Mo/c7-5(6(10)11)1-4-2-8-3-9-4;/h2-3,5H,1,7H2,(H,8,9)(H,10,11);
InChIKeyUMFIYMCYLXYBTK-UHFFFAOYSA-N
XLogP-0.64
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.10
LogP ≤ 5-0.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum?
The IUPAC name of 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum (CID 174573236) is 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum.
What is the SMILES notation for 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum?
The canonical SMILES for 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum is NC(Cc1cnc[nH]1)C(=O)O.[Mo].
What is the InChIKey of 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum?
The InChIKey is UMFIYMCYLXYBTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2.Mo/c7-5(6(10)11)1-4-2-8-3-9-4;/h2-3,5H,1,7H2,(H,8,9)(H,10,11);.
What are the key properties of 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum?
2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum has a molecular weight of 251.10 g/mol, XLogP of -0.64, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(1H-imidazol-5-yl)propanoic acid;molybdenum is sourced from PubChem (CID 174573236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).