2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide

C10H17N3OS — CID 62788372

IUPAC2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
SMILESCCN(CC(C)C)C(=O)c1csc(N)n1
InChIInChI=1S/C10H17N3OS/c1-4-13(5-7(2)3)9(14)8-6-15-10(11)12-8/h6-7H,4-5H2,1-3H3,(H2,11,12)
InChIKeySWIUYXFORMBJSK-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.84
Rot. Bonds4

About 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide

2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide (PubChem CID 62788372) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
PubChem CID62788372
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
SMILESCCN(CC(C)C)C(=O)c1csc(N)n1
InChIInChI=1S/C10H17N3OS/c1-4-13(5-7(2)3)9(14)8-6-15-10(11)12-8/h6-7H,4-5H2,1-3H3,(H2,11,12)
InChIKeySWIUYXFORMBJSK-UHFFFAOYSA-N
XLogP1.84
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-ethyl-N-propyl-1,3-thiazole-4-carboxamide
CID 62788191
3-[(2-amino-1,3-thiazole-4-carbonyl)-ethylamino]propanoic acid
CID 62788466
2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide
CID 62788598
2-amino-N-ethyl-N-(1-methoxypropan-2-yl)-1,3-thiazole-4-carboxamide
CID 62788947
2-amino-N,N-dipentyl-1,3-thiazole-4-carboxamide
CID 62788074
2-amino-N-methyl-N-pentan-3-yl-1,3-thiazole-4-carboxamide
CID 62789071
2-(aminomethyl)-N-ethyl-N-(2-methylbutyl)-1,3-thiazole-4-carboxamide
CID 79470567
2-amino-N-(2-methylbutyl)-1,3-thiazole-4-carboxamide
CID 62787415
2-(1-aminoethyl)-N-ethyl-N-(2-ethylbutyl)-1,3-thiazole-4-carboxamide
CID 66388664
2-amino-N-ethyl-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide
CID 62786731
2-amino-N-[3-(diethylamino)propyl]-1,3-thiazole-4-carboxamide
CID 55116109
2-(aminomethyl)-N-ethyl-N-(2-ethylbutyl)-1,3-thiazole-4-carboxamide;hydrochloride
CID 119727919

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide (CID 62788372) is 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide is CCN(CC(C)C)C(=O)c1csc(N)n1.
What is the InChIKey of 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide?
The InChIKey is SWIUYXFORMBJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-4-13(5-7(2)3)9(14)8-6-15-10(11)12-8/h6-7H,4-5H2,1-3H3,(H2,11,12).
What are the key properties of 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide?
2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide has a molecular weight of 227.33 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 62788372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).