(2R)-2-azidobutanamide

C4H8N4O — CID 150339311

IUPAC(2R)-2-azidobutanamide
SMILESCC[C@@H](N=[N+]=[N-])C(N)=O
InChIInChI=1S/C4H8N4O/c1-2-3(4(5)9)7-8-6/h3H,2H2,1H3,(H2,5,9)/t3-/m1/s1
InChIKeyGRJAEKOIAMRJSN-GSVOUGTGSA-N
MW128.13 g/mol
LogP0.56
Rot. Bonds3

About (2R)-2-azidobutanamide

(2R)-2-azidobutanamide (PubChem CID 150339311) has the molecular formula C4H8N4O and a molecular weight of 128.13 g/mol. Its IUPAC name is (2R)-2-azidobutanamide.

Molecular Properties

Compound Name(2R)-2-azidobutanamide
PubChem CID150339311
Molecular FormulaC4H8N4O
Molecular Weight128.13 g/mol
Exact Mass128.07
IUPAC Name(2R)-2-azidobutanamide
SMILESCC[C@@H](N=[N+]=[N-])C(N)=O
InChIInChI=1S/C4H8N4O/c1-2-3(4(5)9)7-8-6/h3H,2H2,1H3,(H2,5,9)/t3-/m1/s1
InChIKeyGRJAEKOIAMRJSN-GSVOUGTGSA-N
XLogP0.56
TPSA91.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-azidobutanamide?
The IUPAC name of (2R)-2-azidobutanamide (CID 150339311) is (2R)-2-azidobutanamide.
What is the SMILES notation for (2R)-2-azidobutanamide?
The canonical SMILES for (2R)-2-azidobutanamide is CC[C@@H](N=[N+]=[N-])C(N)=O.
What is the InChIKey of (2R)-2-azidobutanamide?
The InChIKey is GRJAEKOIAMRJSN-GSVOUGTGSA-N. The full InChI is InChI=1S/C4H8N4O/c1-2-3(4(5)9)7-8-6/h3H,2H2,1H3,(H2,5,9)/t3-/m1/s1.
What are the key properties of (2R)-2-azidobutanamide?
(2R)-2-azidobutanamide has a molecular weight of 128.13 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-azidobutanamide is sourced from PubChem (CID 150339311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).