2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide

C10H10N4OS — CID 66377402

IUPAC2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide
SMILESNCc1nc(C(=O)Nc2ccccn2)cs1
InChIInChI=1S/C10H10N4OS/c11-5-9-13-7(6-16-9)10(15)14-8-3-1-2-4-12-8/h1-4,6H,5,11H2,(H,12,14,15)
InChIKeyQFMUOGDYKDRQKN-UHFFFAOYSA-N
MW234.28 g/mol
LogP1.25
Rot. Bonds3

About 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide

2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide (PubChem CID 66377402) has the molecular formula C10H10N4OS and a molecular weight of 234.28 g/mol. Its IUPAC name is 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide
PubChem CID66377402
Molecular FormulaC10H10N4OS
Molecular Weight234.28 g/mol
Exact Mass234.06
IUPAC Name2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide
SMILESNCc1nc(C(=O)Nc2ccccn2)cs1
InChIInChI=1S/C10H10N4OS/c11-5-9-13-7(6-16-9)10(15)14-8-3-1-2-4-12-8/h1-4,6H,5,11H2,(H,12,14,15)
InChIKeyQFMUOGDYKDRQKN-UHFFFAOYSA-N
XLogP1.25
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-bromo-N-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 164646931
2-(aminomethyl)-N-(pyridin-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 66377414
2-(aminomethyl)-N-(2-chloro-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 66377243
2-[(5-hydroxy-2-sulfanylphenyl)methyl]-N-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 143316334
2-(aminomethyl)-N-pyridin-4-yl-1,3-thiazole-4-carboxamide
CID 66378569
2-(2,6-difluorophenyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 90286724
2-(aminomethyl)-N-(2-methoxy-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 66375890
2-(aminomethyl)-N-quinolin-6-yl-1,3-thiazole-4-carboxamide
CID 66378461
2-(aminomethyl)-N-(1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide
CID 114387899
2-(aminomethyl)-N-(2-cyanophenyl)-1,3-thiazole-4-carboxamide
CID 66375860
2-(aminomethyl)-N-(2,3-dichlorophenyl)-1,3-thiazole-4-carboxamide
CID 66375672
2-(aminomethyl)-N-(2-methylsulfonylphenyl)-1,3-thiazole-4-carboxamide
CID 66376858

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide (CID 66377402) is 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide is NCc1nc(C(=O)Nc2ccccn2)cs1.
What is the InChIKey of 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide?
The InChIKey is QFMUOGDYKDRQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4OS/c11-5-9-13-7(6-16-9)10(15)14-8-3-1-2-4-12-8/h1-4,6H,5,11H2,(H,12,14,15).
What are the key properties of 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide?
2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide has a molecular weight of 234.28 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 66377402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).