2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide

C12H14N4OS — CID 62793747

IUPAC2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide
SMILESCc1nc(N)sc1C(=O)NC(C)c1ccccn1
InChIInChI=1S/C12H14N4OS/c1-7(9-5-3-4-6-14-9)15-11(17)10-8(2)16-12(13)18-10/h3-7H,1-2H3,(H2,13,16)(H,15,17)
InChIKeyWLRGJPBOAISAAY-UHFFFAOYSA-N
MW262.34 g/mol
LogP1.92
Rot. Bonds3

About 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide

2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide (PubChem CID 62793747) has the molecular formula C12H14N4OS and a molecular weight of 262.34 g/mol. Its IUPAC name is 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide
PubChem CID62793747
Molecular FormulaC12H14N4OS
Molecular Weight262.34 g/mol
Exact Mass262.09
IUPAC Name2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide
SMILESCc1nc(N)sc1C(=O)NC(C)c1ccccn1
InChIInChI=1S/C12H14N4OS/c1-7(9-5-3-4-6-14-9)15-11(17)10-8(2)16-12(13)18-10/h3-7H,1-2H3,(H2,13,16)(H,15,17)
InChIKeyWLRGJPBOAISAAY-UHFFFAOYSA-N
XLogP1.92
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.34
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-N-[(1R)-1-pyridin-2-ylethyl]-2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide
CID 94588634
3-methyl-N-(1-pyridin-2-ylethyl)thiophene-2-carboxamide
CID 43007029
2-amino-N-[(1S)-1-(4-chlorophenyl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 81354288
4-amino-N-[(1S)-1-pyridin-2-ylethyl]benzamide
CID 81407597
2-amino-N-[1-(3-bromophenyl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 55115157
5-amino-N-(1-pyridin-2-ylethyl)-1-benzothiophene-2-carboxamide
CID 61094816
N-[(1R)-1-pyridin-2-ylethyl]thiophene-2-carboxamide
CID 35940231
2-bromo-2-methyl-N-(1-pyridin-2-ylethyl)propanamide
CID 114327632
3-amino-4-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 43524264
5-amino-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide
CID 81315746
3-hydroxy-2-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 82829719
2,2-dimethyl-N-(1-pyridin-2-ylethyl)propanamide
CID 60629083

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide (CID 62793747) is 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide is Cc1nc(N)sc1C(=O)NC(C)c1ccccn1.
What is the InChIKey of 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide?
The InChIKey is WLRGJPBOAISAAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4OS/c1-7(9-5-3-4-6-14-9)15-11(17)10-8(2)16-12(13)18-10/h3-7H,1-2H3,(H2,13,16)(H,15,17).
What are the key properties of 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide?
2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide has a molecular weight of 262.34 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-N-(1-pyridin-2-ylethyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 62793747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).