5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide

C12H14N4OS — CID 113436186

IUPAC5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCc2cscn2)nc1
InChIInChI=1S/C12H14N4OS/c1-2-13-9-3-4-11(14-5-9)12(17)15-6-10-7-18-8-16-10/h3-5,7-8,13H,2,6H2,1H3,(H,15,17)
InChIKeyXULDHTBGPXCPKR-UHFFFAOYSA-N
MW262.34 g/mol
LogP1.90
Rot. Bonds5

About 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide

5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide (PubChem CID 113436186) has the molecular formula C12H14N4OS and a molecular weight of 262.34 g/mol. Its IUPAC name is 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide
PubChem CID113436186
Molecular FormulaC12H14N4OS
Molecular Weight262.34 g/mol
Exact Mass262.09
IUPAC Name5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCc2cscn2)nc1
InChIInChI=1S/C12H14N4OS/c1-2-13-9-3-4-11(14-5-9)12(17)15-6-10-7-18-8-16-10/h3-5,7-8,13H,2,6H2,1H3,(H,15,17)
InChIKeyXULDHTBGPXCPKR-UHFFFAOYSA-N
XLogP1.90
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.34
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
CID 113436174
N-[(4-bromophenyl)methyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104639845
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
5-(ethylamino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 104639989
5-(ethylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 104639627
5-(ethylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104641317
5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide
CID 102908038
2-methyl-6-(1,3-thiazol-4-ylmethylcarbamoyl)pyridine-3-carboxylic acid
CID 63824354
6-chloro-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide
CID 62413892
5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide
CID 106327192
5-(ethylamino)-N,N-dimethylpyridine-2-carboxamide
CID 104639848
N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide
CID 104641173

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide (CID 113436186) is 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide is CCNc1ccc(C(=O)NCc2cscn2)nc1.
What is the InChIKey of 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide?
The InChIKey is XULDHTBGPXCPKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4OS/c1-2-13-9-3-4-11(14-5-9)12(17)15-6-10-7-18-8-16-10/h3-5,7-8,13H,2,6H2,1H3,(H,15,17).
What are the key properties of 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide?
5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide has a molecular weight of 262.34 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 113436186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).