2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide

C10H17N3OS — CID 66374176

IUPAC2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide
SMILESCC(C)(C)NC(=O)c1csc(CCN)n1
InChIInChI=1S/C10H17N3OS/c1-10(2,3)13-9(14)7-6-15-8(12-7)4-5-11/h6H,4-5,11H2,1-3H3,(H,13,14)
InChIKeyTUUDSWOLGWWIOX-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.17
Rot. Bonds3

About 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide

2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide (PubChem CID 66374176) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide
PubChem CID66374176
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide
SMILESCC(C)(C)NC(=O)c1csc(CCN)n1
InChIInChI=1S/C10H17N3OS/c1-10(2,3)13-9(14)7-6-15-8(12-7)4-5-11/h6H,4-5,11H2,1-3H3,(H,13,14)
InChIKeyTUUDSWOLGWWIOX-UHFFFAOYSA-N
XLogP1.17
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-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

2-(2-aminoethyl)-N-(2,4,4-trimethylpentan-2-yl)-1,3-thiazole-4-carboxamide;hydrochloride
CID 120616584
2-(2-aminoethyl)-N-[2-(tert-butylamino)-2-oxoethyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 120618626
2-(2-aminoethyl)-N-methyl-1,3-thiazole-4-carboxamide
CID 66375134
ethyl 2-[[2-(2-aminoethyl)-1,3-thiazole-4-carbonyl]amino]-2-methylpropanoate
CID 120630693
2-(2-aminoethyl)-N-(1-methoxy-2-methylpropan-2-yl)-1,3-thiazole-4-carboxamide;hydrochloride
CID 120628805
2-(2-aminoethyl)-N-[3-(tert-butylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 120621017
2-(2-aminoethyl)-N-[2-(4-methyl-1,3-thiazol-2-yl)butan-2-yl]-1,3-thiazole-4-carboxamide
CID 120647240
N,2-bis(2-aminoethyl)-1,3-thiazole-4-carboxamide
CID 66389522
N-(3-amino-2,2-dimethyl-3-oxopropyl)-2-(2-aminoethyl)-1,3-thiazole-4-carboxamide;hydrochloride
CID 120623914
2-(2-aminoethyl)-N-[2-methyl-1-(2-methylphenyl)propan-2-yl]-1,3-thiazole-4-carboxamide
CID 120630938
2-(2-aminoethyl)-N-[(4-tert-butylphenyl)methyl]-1,3-thiazole-4-carboxamide
CID 120620358
2-(2-aminoethyl)-N-[(4-tert-butylphenyl)methyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 120620357

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide (CID 66374176) is 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide is CC(C)(C)NC(=O)c1csc(CCN)n1.
What is the InChIKey of 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide?
The InChIKey is TUUDSWOLGWWIOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-10(2,3)13-9(14)7-6-15-8(12-7)4-5-11/h6H,4-5,11H2,1-3H3,(H,13,14).
What are the key properties of 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide?
2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide has a molecular weight of 227.33 g/mol, XLogP of 1.17, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-N-tert-butyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 66374176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).