(4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone

C11H7BrN4O — CID 175899392

IUPAC(4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone
SMILESO=C(c1cnn2cccc(Br)c12)n1ccnc1
InChIInChI=1S/C11H7BrN4O/c12-9-2-1-4-16-10(9)8(6-14-16)11(17)15-5-3-13-7-15/h1-7H
InChIKeyYQEFVPYBXDQPMD-UHFFFAOYSA-N
MW291.11 g/mol
LogP1.98
Rot. Bonds1

About (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone

(4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone (PubChem CID 175899392) has the molecular formula C11H7BrN4O and a molecular weight of 291.11 g/mol. Its IUPAC name is (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone.

Molecular Properties

Compound Name(4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone
PubChem CID175899392
Molecular FormulaC11H7BrN4O
Molecular Weight291.11 g/mol
Exact Mass289.98
IUPAC Name(4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone
SMILESO=C(c1cnn2cccc(Br)c12)n1ccnc1
InChIInChI=1S/C11H7BrN4O/c12-9-2-1-4-16-10(9)8(6-14-16)11(17)15-5-3-13-7-15/h1-7H
InChIKeyYQEFVPYBXDQPMD-UHFFFAOYSA-N
XLogP1.98
TPSA52.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.11
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone?
The IUPAC name of (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone (CID 175899392) is (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone.
What is the SMILES notation for (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone?
The canonical SMILES for (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone is O=C(c1cnn2cccc(Br)c12)n1ccnc1.
What is the InChIKey of (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone?
The InChIKey is YQEFVPYBXDQPMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrN4O/c12-9-2-1-4-16-10(9)8(6-14-16)11(17)15-5-3-13-7-15/h1-7H.
What are the key properties of (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone?
(4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone has a molecular weight of 291.11 g/mol, XLogP of 1.98, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromopyrazolo[1,5-a]pyridin-3-yl)-imidazol-1-ylmethanone is sourced from PubChem (CID 175899392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).