3-amino-N-(4-bromophenyl)pyridine-4-carboxamide

C12H10BrN3O — CID 23633070

IUPAC3-amino-N-(4-bromophenyl)pyridine-4-carboxamide
SMILESNc1cnccc1C(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C12H10BrN3O/c13-8-1-3-9(4-2-8)16-12(17)10-5-6-15-7-11(10)14/h1-7H,14H2,(H,16,17)
InChIKeyBTGMHZGOBBABRX-UHFFFAOYSA-N
MW292.14 g/mol
LogP2.68
Rot. Bonds2

About 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide

3-amino-N-(4-bromophenyl)pyridine-4-carboxamide (PubChem CID 23633070) has the molecular formula C12H10BrN3O and a molecular weight of 292.14 g/mol. Its IUPAC name is 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-bromophenyl)pyridine-4-carboxamide
PubChem CID23633070
Molecular FormulaC12H10BrN3O
Molecular Weight292.14 g/mol
Exact Mass291.00
IUPAC Name3-amino-N-(4-bromophenyl)pyridine-4-carboxamide
SMILESNc1cnccc1C(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C12H10BrN3O/c13-8-1-3-9(4-2-8)16-12(17)10-5-6-15-7-11(10)14/h1-7H,14H2,(H,16,17)
InChIKeyBTGMHZGOBBABRX-UHFFFAOYSA-N
XLogP2.68
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.14
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(3-bromo-4-chlorophenyl)pyridine-4-carboxamide
CID 105070699
3-amino-N-thiophen-3-ylpyridine-4-carboxamide
CID 105070561
3-amino-N-(3-fluorophenyl)pyridine-4-carboxamide
CID 23633068
2-amino-N-pyridin-4-ylbenzamide
CID 5080262
N-(4-amino-3-bromophenyl)-3-methoxypyridine-4-carboxamide
CID 105063037
4-amino-N-(4-nitrophenyl)pyridine-3-carboxamide
CID 81236039
methyl 4-[(4-aminopyridine-3-carbonyl)amino]benzoate
CID 110861759
3-amino-N-(2-chlorophenyl)pyridine-4-carboxamide
CID 23633071
5-amino-N-(4-bromophenyl)-1-methylpyrazole-4-carboxamide
CID 80504044
4-amino-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 81235962
3-amino-N-(2-chloro-4-methylphenyl)pyridine-4-carboxamide
CID 105068439
2-amino-4-bromo-N-(4-chloro-3-pyridinyl)benzamide
CID 83167499

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide?
The IUPAC name of 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide (CID 23633070) is 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide?
The canonical SMILES for 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide is Nc1cnccc1C(=O)Nc1ccc(Br)cc1.
What is the InChIKey of 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide?
The InChIKey is BTGMHZGOBBABRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN3O/c13-8-1-3-9(4-2-8)16-12(17)10-5-6-15-7-11(10)14/h1-7H,14H2,(H,16,17).
What are the key properties of 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide?
3-amino-N-(4-bromophenyl)pyridine-4-carboxamide has a molecular weight of 292.14 g/mol, XLogP of 2.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-bromophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 23633070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).