5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide

C10H8Br2N4O — CID 61475532

IUPAC5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide
SMILESNc1[nH]ncc1C(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C10H8Br2N4O/c11-5-1-2-8(7(12)3-5)15-10(17)6-4-14-16-9(6)13/h1-4H,(H,15,17)(H3,13,14,16)
InChIKeyAHQLHBBHXNEJKJ-UHFFFAOYSA-N
MW360.01 g/mol
LogP2.77
Rot. Bonds2

About 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide

5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide (PubChem CID 61475532) has the molecular formula C10H8Br2N4O and a molecular weight of 360.01 g/mol. Its IUPAC name is 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide
PubChem CID61475532
Molecular FormulaC10H8Br2N4O
Molecular Weight360.01 g/mol
Exact Mass357.91
IUPAC Name5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide
SMILESNc1[nH]ncc1C(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C10H8Br2N4O/c11-5-1-2-8(7(12)3-5)15-10(17)6-4-14-16-9(6)13/h1-4H,(H,15,17)(H3,13,14,16)
InChIKeyAHQLHBBHXNEJKJ-UHFFFAOYSA-N
XLogP2.77
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.01
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-(2-bromo-5-methylphenyl)-1H-pyrazole-4-carboxamide
CID 82766729
2-amino-5-bromo-N-(2,4-dibromophenyl)pyridine-3-carboxamide
CID 62187349
5-amino-N-(2-hydroxy-5-methylphenyl)-1H-pyrazole-4-carboxamide
CID 110484171
5-amino-N-(4-iodophenyl)-1H-pyrazole-4-carboxamide
CID 43159637
N-(2,4-dibromophenyl)-3-hydroxypyridine-4-carboxamide
CID 81442512
2-amino-4-chloro-N-(2,4-dibromophenyl)benzamide
CID 61471749
4-bromo-N-(2,4-dibromophenyl)-2-fluorobenzamide
CID 26691585
6-amino-N-(2,4-dibromophenyl)pyridazine-3-carboxamide
CID 62187350
5-amino-N-[2-(dimethylamino)phenyl]-1H-pyrazole-4-carboxamide
CID 106760594
2-amino-4-bromo-N-(2-bromo-4-chlorophenyl)benzamide
CID 81263873
4-amino-N-(2,4-dibromophenyl)-3,5-difluorobenzamide
CID 63185804
N-(2,4-dibromophenyl)-2,3-difluorobenzamide
CID 55099912

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide (CID 61475532) is 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide is Nc1[nH]ncc1C(=O)Nc1ccc(Br)cc1Br.
What is the InChIKey of 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide?
The InChIKey is AHQLHBBHXNEJKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Br2N4O/c11-5-1-2-8(7(12)3-5)15-10(17)6-4-14-16-9(6)13/h1-4H,(H,15,17)(H3,13,14,16).
What are the key properties of 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide?
5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide has a molecular weight of 360.01 g/mol, XLogP of 2.77, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2,4-dibromophenyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 61475532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).