2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide

C11H19N3OS — CID 62788598

IUPAC2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide
SMILESCC(C)CC(C)N(C)C(=O)c1csc(N)n1
InChIInChI=1S/C11H19N3OS/c1-7(2)5-8(3)14(4)10(15)9-6-16-11(12)13-9/h6-8H,5H2,1-4H3,(H2,12,13)
InChIKeyOTCXJFPRPKDLLP-UHFFFAOYSA-N
MW241.36 g/mol
LogP2.23
Rot. Bonds4

About 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide

2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide (PubChem CID 62788598) has the molecular formula C11H19N3OS and a molecular weight of 241.36 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide
PubChem CID62788598
Molecular FormulaC11H19N3OS
Molecular Weight241.36 g/mol
Exact Mass241.12
IUPAC Name2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide
SMILESCC(C)CC(C)N(C)C(=O)c1csc(N)n1
InChIInChI=1S/C11H19N3OS/c1-7(2)5-8(3)14(4)10(15)9-6-16-11(12)13-9/h6-8H,5H2,1-4H3,(H2,12,13)
InChIKeyOTCXJFPRPKDLLP-UHFFFAOYSA-N
XLogP2.23
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-methyl-N-(4-methylpentan-2-yl)-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-amino-N-methyl-N-pentan-3-yl-1,3-thiazole-4-carboxamide
CID 62789071
2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
CID 62788372
2-amino-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)-1,3-thiazole-4-carboxamide
CID 79494174
2-amino-N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-1,3-thiazole-4-carboxamide
CID 62788080
1-(2-amino-1,3-thiazol-4-yl)-2-(dimethylamino)ethanone;hydrobromide
CID 170895769
2-amino-N-ethyl-N-propyl-1,3-thiazole-4-carboxamide
CID 62788191
2-amino-N-(2-methylbutyl)-1,3-thiazole-4-carboxamide
CID 62787415
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
ethyl 4-[1-hydroxypropan-2-yl(methyl)carbamoyl]-1,3-thiazole-2-carboxylate
CID 116698241
2-amino-N-[3-(dimethylamino)propyl]-N-methyl-1,3-thiazole-4-carboxamide
CID 63692953
N,2-dimethyl-N-[(2R)-4-methylpentan-2-yl]pyrimidine-4-carboxamide
CID 97313105

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide (CID 62788598) is 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide is CC(C)CC(C)N(C)C(=O)c1csc(N)n1.
What is the InChIKey of 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is OTCXJFPRPKDLLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3OS/c1-7(2)5-8(3)14(4)10(15)9-6-16-11(12)13-9/h6-8H,5H2,1-4H3,(H2,12,13).
What are the key properties of 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide?
2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 241.36 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 62788598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).