N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide

C11H10BrClN4OS — CID 62179840

IUPACN-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncc(C(=O)Nc2ncc(Br)s2)cc1Cl
InChIInChI=1S/C11H10BrClN4OS/c1-2-14-9-7(13)3-6(4-15-9)10(18)17-11-16-5-8(12)19-11/h3-5H,2H2,1H3,(H,14,15)(H,16,17,18)
InChIKeyNNPDQHAWPGVQMB-UHFFFAOYSA-N
MW361.65 g/mol
LogP3.64
Rot. Bonds4

About N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide

N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide (PubChem CID 62179840) has the molecular formula C11H10BrClN4OS and a molecular weight of 361.65 g/mol. Its IUPAC name is N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide
PubChem CID62179840
Molecular FormulaC11H10BrClN4OS
Molecular Weight361.65 g/mol
Exact Mass359.94
IUPAC NameN-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncc(C(=O)Nc2ncc(Br)s2)cc1Cl
InChIInChI=1S/C11H10BrClN4OS/c1-2-14-9-7(13)3-6(4-15-9)10(18)17-11-16-5-8(12)19-11/h3-5H,2H2,1H3,(H,14,15)(H,16,17,18)
InChIKeyNNPDQHAWPGVQMB-UHFFFAOYSA-N
XLogP3.64
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.65
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-6-(ethylamino)-N-thiophen-3-ylpyridine-3-carboxamide
CID 66353786
N-(5-bromo-2-fluorophenyl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide
CID 62168364
5-chloro-6-hydrazinyl-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 62249389
N-(5-bromo-1,3-thiazol-2-yl)-5-(ethylamino)-1,3,4-thiadiazole-2-carboxamide
CID 80615212
5-chloro-6-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 62176197
5-chloro-6-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-3-carboxamide
CID 62166153
N-(5-bromo-1,3-thiazol-2-yl)-4-(ethylamino)-3-nitrobenzamide
CID 62180552
5-chloro-6-(ethylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide
CID 55071772
5-chloro-6-(ethylamino)-N-hexan-3-ylpyridine-3-carboxamide
CID 62179174
6-bromo-N-(5-bromo-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 66462491
N-(5-bromo-1,3-thiazol-2-yl)-4-propan-2-ylbenzamide
CID 60654890
2-amino-N-(5-bromo-1,3-thiazol-2-yl)-6-chloropyridine-4-carboxamide
CID 62160793

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide (CID 62179840) is N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide is CCNc1ncc(C(=O)Nc2ncc(Br)s2)cc1Cl.
What is the InChIKey of N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide?
The InChIKey is NNPDQHAWPGVQMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrClN4OS/c1-2-14-9-7(13)3-6(4-15-9)10(18)17-11-16-5-8(12)19-11/h3-5H,2H2,1H3,(H,14,15)(H,16,17,18).
What are the key properties of N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide?
N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide has a molecular weight of 361.65 g/mol, XLogP of 3.64, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-1,3-thiazol-2-yl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62179840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).