2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine

C10H10N6 — CID 139488027

IUPAC2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine
SMILES[N-]=[N+]=NCc1cn2cc(C3CC3)cnc2n1
InChIInChI=1S/C10H10N6/c11-15-13-4-9-6-16-5-8(7-1-2-7)3-12-10(16)14-9/h3,5-7H,1-2,4H2
InChIKeyYGBGLEQEAZNNHL-UHFFFAOYSA-N
MW214.23 g/mol
LogP2.42
Rot. Bonds3

About 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine

2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine (PubChem CID 139488027) has the molecular formula C10H10N6 and a molecular weight of 214.23 g/mol. Its IUPAC name is 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine
PubChem CID139488027
Molecular FormulaC10H10N6
Molecular Weight214.23 g/mol
Exact Mass214.10
IUPAC Name2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine
SMILES[N-]=[N+]=NCc1cn2cc(C3CC3)cnc2n1
InChIInChI=1S/C10H10N6/c11-15-13-4-9-6-16-5-8(7-1-2-7)3-12-10(16)14-9/h3,5-7H,1-2,4H2
InChIKeyYGBGLEQEAZNNHL-UHFFFAOYSA-N
XLogP2.42
TPSA78.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine?
The IUPAC name of 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine (CID 139488027) is 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine is [N-]=[N+]=NCc1cn2cc(C3CC3)cnc2n1.
What is the InChIKey of 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine?
The InChIKey is YGBGLEQEAZNNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6/c11-15-13-4-9-6-16-5-8(7-1-2-7)3-12-10(16)14-9/h3,5-7H,1-2,4H2.
What are the key properties of 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine?
2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine has a molecular weight of 214.23 g/mol, XLogP of 2.42, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azidomethyl)-6-cyclopropylimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 139488027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).