2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine

C14H13BrN4 — CID 103128137

IUPAC2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
SMILESNC(Cc1cncc(Br)c1)c1cnn2ccccc12
InChIInChI=1S/C14H13BrN4/c15-11-5-10(7-17-8-11)6-13(16)12-9-18-19-4-2-1-3-14(12)19/h1-5,7-9,13H,6,16H2
InChIKeyLYJMNLPJFJEFRM-UHFFFAOYSA-N
MW317.19 g/mol
LogP2.73
Rot. Bonds3

About 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine

2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine (PubChem CID 103128137) has the molecular formula C14H13BrN4 and a molecular weight of 317.19 g/mol. Its IUPAC name is 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
PubChem CID103128137
Molecular FormulaC14H13BrN4
Molecular Weight317.19 g/mol
Exact Mass316.03
IUPAC Name2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
SMILESNC(Cc1cncc(Br)c1)c1cnn2ccccc12
InChIInChI=1S/C14H13BrN4/c15-11-5-10(7-17-8-11)6-13(16)12-9-18-19-4-2-1-3-14(12)19/h1-5,7-9,13H,6,16H2
InChIKeyLYJMNLPJFJEFRM-UHFFFAOYSA-N
XLogP2.73
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.19
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-propan-2-ylphenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103126751
2-(5-bromo-3-pyridinyl)-1-(2-chlorophenyl)ethanamine
CID 113454887
2-(3-chloro-4-fluorophenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103128465
2-(5-chloro-2-fluorophenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103128470
2-(5-bromo-3-pyridinyl)-1-(2,3-dimethylphenyl)ethanamine
CID 105036926
1-(1-benzothiophen-2-yl)-2-(5-bromo-3-pyridinyl)ethanamine
CID 105036767
2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103127530
2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103126126
2-(5-bromo-3-pyridinyl)-1-(2,4-dimethylphenyl)ethanamine
CID 105036620
2-(5-bromo-3-pyridinyl)-1-(3-fluoro-4-pyridinyl)ethanamine
CID 113455102
2-(5-bromo-3-pyridinyl)-1-(2,3,4-trifluorophenyl)ethanamine
CID 105036649
2-(5-bromo-3-pyridinyl)-1-(3-chloro-4-pyridinyl)ethanamine
CID 105181188

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine?
The IUPAC name of 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine (CID 103128137) is 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine.
What is the SMILES notation for 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine?
The canonical SMILES for 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine is NC(Cc1cncc(Br)c1)c1cnn2ccccc12.
What is the InChIKey of 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine?
The InChIKey is LYJMNLPJFJEFRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN4/c15-11-5-10(7-17-8-11)6-13(16)12-9-18-19-4-2-1-3-14(12)19/h1-5,7-9,13H,6,16H2.
What are the key properties of 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine?
2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine has a molecular weight of 317.19 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-3-pyridinyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine is sourced from PubChem (CID 103128137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).