6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide

C14H11BrN4O — CID 155985788

IUPAC6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide
SMILESO=C(NCc1cccnc1)c1cc2ccc(Br)cn2n1
InChIInChI=1S/C14H11BrN4O/c15-11-3-4-12-6-13(18-19(12)9-11)14(20)17-8-10-2-1-5-16-7-10/h1-7,9H,8H2,(H,17,20)
InChIKeyANJCSDKIFGLHKJ-UHFFFAOYSA-N
MW331.17 g/mol
LogP2.42
Rot. Bonds3

About 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide

6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide (PubChem CID 155985788) has the molecular formula C14H11BrN4O and a molecular weight of 331.17 g/mol. Its IUPAC name is 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide
PubChem CID155985788
Molecular FormulaC14H11BrN4O
Molecular Weight331.17 g/mol
Exact Mass330.01
IUPAC Name6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide
SMILESO=C(NCc1cccnc1)c1cc2ccc(Br)cn2n1
InChIInChI=1S/C14H11BrN4O/c15-11-3-4-12-6-13(18-19(12)9-11)14(20)17-8-10-2-1-5-16-7-10/h1-7,9H,8H2,(H,17,20)
InChIKeyANJCSDKIFGLHKJ-UHFFFAOYSA-N
XLogP2.42
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.17
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-N,5-N-bis(pyridin-3-ylmethyl)pyrazole-3,5-dicarboxamide
CID 29097126
2-(5-bromo-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide
CID 142612479
4-bromo-1-cyclopropyl-N-(pyridin-3-ylmethyl)pyrrole-2-carboxamide
CID 43641323
6-chloro-N-(pyridin-3-ylmethyl)pyridazine-3-carboxamide
CID 54927031
2,3,5,6-tetrafluoro-1-N,4-N-bis(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 1204787
3-bromo-5-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 104851859
3-bromo-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 107517841
5-bromo-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 750404
4-chloro-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 25345003
N-(pyridin-3-ylmethyl)-4-pyrrol-1-ylpyridine-2-carboxamide
CID 71801417
5-bromo-2-chloro-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 62000615
6-(pyridin-3-ylmethylcarbamoyl)pyridine-2-carboxylic acid
CID 43558442

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide?
The IUPAC name of 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide (CID 155985788) is 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide?
The canonical SMILES for 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide is O=C(NCc1cccnc1)c1cc2ccc(Br)cn2n1.
What is the InChIKey of 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide?
The InChIKey is ANJCSDKIFGLHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrN4O/c15-11-3-4-12-6-13(18-19(12)9-11)14(20)17-8-10-2-1-5-16-7-10/h1-7,9H,8H2,(H,17,20).
What are the key properties of 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide?
6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide has a molecular weight of 331.17 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyridine-2-carboxamide is sourced from PubChem (CID 155985788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).