2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine

C17H18BrN3 — CID 103126126

IUPAC2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
SMILESCCNC(Cc1cccc(Br)c1)c1cnn2ccccc12
InChIInChI=1S/C17H18BrN3/c1-2-19-16(11-13-6-5-7-14(18)10-13)15-12-20-21-9-4-3-8-17(15)21/h3-10,12,16,19H,2,11H2,1H3
InChIKeyJVMAULNCKANNBC-UHFFFAOYSA-N
MW344.26 g/mol
LogP3.99
Rot. Bonds5

About 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine

2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine (PubChem CID 103126126) has the molecular formula C17H18BrN3 and a molecular weight of 344.26 g/mol. Its IUPAC name is 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
PubChem CID103126126
Molecular FormulaC17H18BrN3
Molecular Weight344.26 g/mol
Exact Mass343.07
IUPAC Name2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
SMILESCCNC(Cc1cccc(Br)c1)c1cnn2ccccc12
InChIInChI=1S/C17H18BrN3/c1-2-19-16(11-13-6-5-7-14(18)10-13)15-12-20-21-9-4-3-8-17(15)21/h3-10,12,16,19H,2,11H2,1H3
InChIKeyJVMAULNCKANNBC-UHFFFAOYSA-N
XLogP3.99
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.26
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(4-iodophenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103127281
2-(5-bromo-2-pyridinyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103128127
2-(3-bromophenyl)-N-ethyl-1-(2-methylphenyl)ethanamine
CID 60819413
N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylbut-3-en-1-amine
CID 103126360
N-ethyl-2-(1-methyltriazol-4-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 107064291
2-(3-bromophenyl)-1-(2,5-dibromophenyl)-N-ethylethanamine
CID 63508792
2-(4-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126121
2-(3-bromophenyl)-N-ethyl-1-(2,4,5-trimethylphenyl)ethanamine
CID 64990001
2-(3-bromophenyl)-1-(3-chloro-4-pyridinyl)-N-ethylethanamine
CID 105089739
2-(3-bromophenyl)-N-ethyl-1-pyrimidin-5-ylethanamine
CID 62491546
2-(3-bromophenyl)-1-(4-chloro-1-methylpyrazol-5-yl)-N-ethylethanamine
CID 114648016
2-(3-bromophenyl)-N-ethyl-1-pyridazin-4-ylethanamine
CID 105089518

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine?
The IUPAC name of 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine (CID 103126126) is 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine.
What is the SMILES notation for 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine?
The canonical SMILES for 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine is CCNC(Cc1cccc(Br)c1)c1cnn2ccccc12.
What is the InChIKey of 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine?
The InChIKey is JVMAULNCKANNBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18BrN3/c1-2-19-16(11-13-6-5-7-14(18)10-13)15-12-20-21-9-4-3-8-17(15)21/h3-10,12,16,19H,2,11H2,1H3.
What are the key properties of 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine?
2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine has a molecular weight of 344.26 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)-N-ethyl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine is sourced from PubChem (CID 103126126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).