2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide

C13H21N3OS — CID 62797286

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide
SMILESCCN(C(=O)Cc1csc(N)n1)C1CCCCC1
InChIInChI=1S/C13H21N3OS/c1-2-16(11-6-4-3-5-7-11)12(17)8-10-9-18-13(14)15-10/h9,11H,2-8H2,1H3,(H2,14,15)
InChIKeyKIZMQBDOSGCJCW-UHFFFAOYSA-N
MW267.40 g/mol
LogP2.45
Rot. Bonds4

About 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide

2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide (PubChem CID 62797286) has the molecular formula C13H21N3OS and a molecular weight of 267.40 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide
PubChem CID62797286
Molecular FormulaC13H21N3OS
Molecular Weight267.40 g/mol
Exact Mass267.14
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide
SMILESCCN(C(=O)Cc1csc(N)n1)C1CCCCC1
InChIInChI=1S/C13H21N3OS/c1-2-16(11-6-4-3-5-7-11)12(17)8-10-9-18-13(14)15-10/h9,11H,2-8H2,1H3,(H2,14,15)
InChIKeyKIZMQBDOSGCJCW-UHFFFAOYSA-N
XLogP2.45
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-amino-1,3-thiazol-4-yl)-N-cyclopropyl-N-(2-methoxyethyl)acetamide
CID 62800322
3-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]-cyclopropylamino]propanoic acid
CID 62797687
N-cyclohexyl-N-(2-hydroxyethyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 54942911
2-(2-amino-1,3-thiazol-4-yl)-N-cyclopropyl-N-(thiophen-3-ylmethyl)acetamide
CID 62799810
2-(2-amino-1,3-thiazol-4-yl)-N-(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl)-N-propylacetamide
CID 10970826
2-(2-amino-1,3-thiazol-4-yl)-N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 62797846
N-cyclohexyl-N-[2-(dimethylamino)ethyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 46966961
2-(2-amino-1,3-thiazol-4-yl)-1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanone
CID 104967422
2-(2-amino-1,3-thiazol-4-yl)-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 62799786
3-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]-ethylamino]-2-methylpropanoic acid
CID 62852454
1-(2-amino-1,3-thiazol-4-yl)propan-2-one
CID 22977217
2-(2-amino-1,3-thiazol-4-yl)-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]acetamide
CID 62800141

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide (CID 62797286) is 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide is CCN(C(=O)Cc1csc(N)n1)C1CCCCC1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide?
The InChIKey is KIZMQBDOSGCJCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3OS/c1-2-16(11-6-4-3-5-7-11)12(17)8-10-9-18-13(14)15-10/h9,11H,2-8H2,1H3,(H2,14,15).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide has a molecular weight of 267.40 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-cyclohexyl-N-ethylacetamide is sourced from PubChem (CID 62797286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).