5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide

C10H7BrN4O — CID 29367937

IUPAC5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide
SMILESO=C(Nc1ncccn1)c1cncc(Br)c1
InChIInChI=1S/C10H7BrN4O/c11-8-4-7(5-12-6-8)9(16)15-10-13-2-1-3-14-10/h1-6H,(H,13,14,15,16)
InChIKeyVVRVXUZWACRIEQ-UHFFFAOYSA-N
MW279.10 g/mol
LogP1.89
Rot. Bonds2

About 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide

5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide (PubChem CID 29367937) has the molecular formula C10H7BrN4O and a molecular weight of 279.10 g/mol. Its IUPAC name is 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide
PubChem CID29367937
Molecular FormulaC10H7BrN4O
Molecular Weight279.10 g/mol
Exact Mass277.98
IUPAC Name5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide
SMILESO=C(Nc1ncccn1)c1cncc(Br)c1
InChIInChI=1S/C10H7BrN4O/c11-8-4-7(5-12-6-8)9(16)15-10-13-2-1-3-14-10/h1-6H,(H,13,14,15,16)
InChIKeyVVRVXUZWACRIEQ-UHFFFAOYSA-N
XLogP1.89
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.10
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide
CID 86992070
N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide
CID 154758058
5-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 837055
N'-benzoyl-5-bromopyridine-3-carbohydrazide
CID 40613239
5-bromo-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
CID 731484
5-bromo-N-[4-(carbamoylamino)phenyl]pyridine-3-carboxamide
CID 33152161
5-bromo-N-(4-bromo-3,5-dimethylphenyl)pyridine-3-carboxamide
CID 107574886
2-[(5-bromopyridine-3-carbonyl)amino]benzoic acid
CID 805036
5-bromo-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridine-3-carboxamide
CID 2999617
bis(5-bromo-3-pyridinyl)methanone
CID 150630113
5-bromo-N-(3-ethoxyphenyl)pyridine-3-carboxamide
CID 61061483
5-bromo-N-pyrimidin-2-ylpyridine-2-carboxamide
CID 62952846

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide (CID 29367937) is 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide is O=C(Nc1ncccn1)c1cncc(Br)c1.
What is the InChIKey of 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide?
The InChIKey is VVRVXUZWACRIEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrN4O/c11-8-4-7(5-12-6-8)9(16)15-10-13-2-1-3-14-10/h1-6H,(H,13,14,15,16).
What are the key properties of 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide?
5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide has a molecular weight of 279.10 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 29367937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).