2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide

C10H11N5OS — CID 114914267

IUPAC2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2cnns2)ccn1
InChIInChI=1S/C10H11N5OS/c1-2-11-8-5-7(3-4-12-8)10(16)14-9-6-13-15-17-9/h3-6H,2H2,1H3,(H,11,12)(H,14,16)
InChIKeyVHGRWTPCQXMBKA-UHFFFAOYSA-N
MW249.30 g/mol
LogP1.62
Rot. Bonds4

About 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide

2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide (PubChem CID 114914267) has the molecular formula C10H11N5OS and a molecular weight of 249.30 g/mol. Its IUPAC name is 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide
PubChem CID114914267
Molecular FormulaC10H11N5OS
Molecular Weight249.30 g/mol
Exact Mass249.07
IUPAC Name2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2cnns2)ccn1
InChIInChI=1S/C10H11N5OS/c1-2-11-8-5-7(3-4-12-8)10(16)14-9-6-13-15-17-9/h3-6H,2H2,1H3,(H,11,12)(H,14,16)
InChIKeyVHGRWTPCQXMBKA-UHFFFAOYSA-N
XLogP1.62
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide (CID 114914267) is 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide is CCNc1cc(C(=O)Nc2cnns2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide?
The InChIKey is VHGRWTPCQXMBKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5OS/c1-2-11-8-5-7(3-4-12-8)10(16)14-9-6-13-15-17-9/h3-6H,2H2,1H3,(H,11,12)(H,14,16).
What are the key properties of 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide?
2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide has a molecular weight of 249.30 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(thiadiazol-5-yl)pyridine-4-carboxamide is sourced from PubChem (CID 114914267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).