3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide

C58H52Br2N14O5Sn — CID 157272673

IUPAC3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide
SMILESCNC(=O)c1ccc([Sn](C)(C)C)nc1.N#Cc1ccc(N(C(=O)c2ccn3ncc(-c4ccc(C(N)=O)cn4)c3c2)C2CC2)cc1.N#Cc1ccc(N(C(=O)c2ccn3ncc(Br)c3c2)C2CC2)cc1.NC(=O)c1ccc(Br)nc1
InChIInChI=1S/C24H18N6O2.C18H13BrN4O.C7H7N2O.C6H5BrN2O.3CH3.Sn/c25-12-15-1-4-18(5-2-15)30(19-6-7-19)24(32)16-9-10-29-22(11-16)20(14-28-29)21-8-3-17(13-27-21)23(26)31;19-16-11-21-22-8-7-13(9-17(16)22)18(24)23(15-5-6-15)14-3-1-12(10-20)2-4-14;1-8-7(10)6-3-2-4-9-5-6;7-5-2-1-4(3-9-5)6(8)10;;;;/h1-5,8-11,13-14,19H,6-7H2,(H2,26,31);1-4,7-9,11,15H,5-6H2;2-3,5H,1H3,(H,8,10);1-3H,(H2,8,10);3*1H3;
InChIKeyAYSKUNAFDCZOTD-UHFFFAOYSA-N
MW1303.67 g/mol
LogP8.88
Rot. Bonds11

About 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide

3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide (PubChem CID 157272673) has the molecular formula C58H52Br2N14O5Sn and a molecular weight of 1303.67 g/mol. Its IUPAC name is 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide.

Molecular Properties

Compound Name3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide
PubChem CID157272673
Molecular FormulaC58H52Br2N14O5Sn
Molecular Weight1303.67 g/mol
Exact Mass1302.16
IUPAC Name3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide
SMILESCNC(=O)c1ccc([Sn](C)(C)C)nc1.N#Cc1ccc(N(C(=O)c2ccn3ncc(-c4ccc(C(N)=O)cn4)c3c2)C2CC2)cc1.N#Cc1ccc(N(C(=O)c2ccn3ncc(Br)c3c2)C2CC2)cc1.NC(=O)c1ccc(Br)nc1
InChIInChI=1S/C24H18N6O2.C18H13BrN4O.C7H7N2O.C6H5BrN2O.3CH3.Sn/c25-12-15-1-4-18(5-2-15)30(19-6-7-19)24(32)16-9-10-29-22(11-16)20(14-28-29)21-8-3-17(13-27-21)23(26)31;19-16-11-21-22-8-7-13(9-17(16)22)18(24)23(15-5-6-15)14-3-1-12(10-20)2-4-14;1-8-7(10)6-3-2-4-9-5-6;7-5-2-1-4(3-9-5)6(8)10;;;;/h1-5,8-11,13-14,19H,6-7H2,(H2,26,31);1-4,7-9,11,15H,5-6H2;2-3,5H,1H3,(H,8,10);1-3H,(H2,8,10);3*1H3;
InChIKeyAYSKUNAFDCZOTD-UHFFFAOYSA-N
XLogP8.88
TPSA276.75 Ų
H-Bond Donors3
H-Bond Acceptors14
Rotatable Bonds11
Heavy Atoms80
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001303.67
LogP ≤ 58.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide with MolForge

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Related Compounds

N-(4-cyanophenyl)-N-cyclopropyl-3-(5-(methylcarbamoyl)pyridin-2-yl)pyrazolo[1,5-a]pyridine-5-carboxamide
CID 90157431
2-[2-[2-[1-[3-[5-[bis(3-methylbutyl)carbamoyl]-2-(2-bromophenyl)pyrazolo[1,5-a]pyridin-3-yl]prop-2-enyl]piperidin-2-yl]acetyl]phenyl]-N,N-bis(3-methylbutyl)-3-(3-piperidin-1-ylprop-1-enyl)pyrazolo[1,5-a]pyridine-5-carboxamide
CID 123907554
6-Bromo-4-[[1-(6-cyanopyridazin-3-yl)-3,3-dimethylpiperidin-4-yl]amino]pyrrolo[1,2-b]pyridazine-3-carboxamide;6-bromo-4-[(3,3-dimethylpiperidin-4-yl)amino]pyrrolo[1,2-b]pyridazine-3-carboxamide
CID 157460566
3-(4-acetamidophenyl)-N-(5-cyano-2-pyridinyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide;3-bromo-N-(5-cyano-2-pyridinyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide;methane
CID 157461502
3-bromo-N-(5-cyano-2-pyridinyl)-N-propan-2-ylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromo-N-methylpyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-3-[5-(methylcarbamoyl)-2-pyridinyl]-N-propan-2-ylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide
CID 157499206
3-bromo-N-cyclopropyl-N-(5-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridine-5-carboxamide;N-(5-cyano-2-pyridinyl)-N-cyclopropyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide;[4-(methylcarbamoyl)phenyl]boronic acid
CID 157630211
3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;(6-carbamoyl-3-pyridinyl)boronic acid;3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;palladium;tetrakis(triphenylphosphane)
CID 157737547
3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-(4-cyanophenyl)-N-cyclopropyl-3-[6-(methylcarbamoyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-5-carboxamide;[6-(methylcarbamoyl)-3-pyridinyl]boronic acid;palladium;tetrakis(triphenylphosphane)
CID 157805727
N-(4-aminocyclohexyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-(propan-2-ylamino)pyridine-3-carboxamide;6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-N-[4-(2-oxopropyl)cyclohexyl]-4-(propan-2-ylamino)pyridine-3-carboxamide
CID 157826644
N-[(1S)-1-(2-bromo-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-cyano-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide
CID 157887731
3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-(4-cyanophenyl)-N-cyclopropyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide;methane;[4-(methylcarbamoyl)phenyl]boronic acid
CID 157911087
N-(3-bromopyrazolo[1,5-a]pyridin-5-yl)-5-cyano-N-cyclopropylpyridine-2-carboxamide;5-cyano-N-cyclopropyl-N-[3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridin-5-yl]pyridine-2-carboxamide;[4-(methylcarbamoyl)phenyl]boronic acid
CID 157935694

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide?
The IUPAC name of 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide (CID 157272673) is 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide.
What is the SMILES notation for 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide?
The canonical SMILES for 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide is CNC(=O)c1ccc([Sn](C)(C)C)nc1.N#Cc1ccc(N(C(=O)c2ccn3ncc(-c4ccc(C(N)=O)cn4)c3c2)C2CC2)cc1.N#Cc1ccc(N(C(=O)c2ccn3ncc(Br)c3c2)C2CC2)cc1.NC(=O)c1ccc(Br)nc1.
What is the InChIKey of 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide?
The InChIKey is AYSKUNAFDCZOTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N6O2.C18H13BrN4O.C7H7N2O.C6H5BrN2O.3CH3.Sn/c25-12-15-1-4-18(5-2-15)30(19-6-7-19)24(32)16-9-10-29-22(11-16)20(14-28-29)21-8-3-17(13-27-21)23(26)31;19-16-11-21-22-8-7-13(9-17(16)22)18(24)23(15-5-6-15)14-3-1-12(10-20)2-4-14;1-8-7(10)6-3-2-4-9-5-6;7-5-2-1-4(3-9-5)6(8)10;;;;/h1-5,8-11,13-14,19H,6-7H2,(H2,26,31);1-4,7-9,11,15H,5-6H2;2-3,5H,1H3,(H,8,10);1-3H,(H2,8,10);3*1H3;.
What are the key properties of 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide?
3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide has a molecular weight of 1303.67 g/mol, XLogP of 8.88, 11 rotatable bonds, 3 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromopyridine-3-carboxamide;3-(5-carbamoyl-2-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide;N-methyl-6-trimethylstannylpyridine-3-carboxamide is sourced from PubChem (CID 157272673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).