N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen

C10H18N2OS — CID 176998106

IUPACN-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen
SMILESCCNC(=O)Cc1ncc(C(C)C)s1.[H][H]
InChIInChI=1S/C10H16N2OS.H2/c1-4-11-9(13)5-10-12-6-8(14-10)7(2)3;/h6-7H,4-5H2,1-3H3,(H,11,13);1H
InChIKeyOHXRWROIWDEIOF-UHFFFAOYSA-N
MW214.33 g/mol
LogP2.19
Rot. Bonds4

About N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen

N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen (PubChem CID 176998106) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen.

Molecular Properties

Compound NameN-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen
PubChem CID176998106
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC NameN-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen
SMILESCCNC(=O)Cc1ncc(C(C)C)s1.[H][H]
InChIInChI=1S/C10H16N2OS.H2/c1-4-11-9(13)5-10-12-6-8(14-10)7(2)3;/h6-7H,4-5H2,1-3H3,(H,11,13);1H
InChIKeyOHXRWROIWDEIOF-UHFFFAOYSA-N
XLogP2.19
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen?
The IUPAC name of N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen (CID 176998106) is N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen.
What is the SMILES notation for N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen?
The canonical SMILES for N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen is CCNC(=O)Cc1ncc(C(C)C)s1.[H][H].
What is the InChIKey of N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen?
The InChIKey is OHXRWROIWDEIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS.H2/c1-4-11-9(13)5-10-12-6-8(14-10)7(2)3;/h6-7H,4-5H2,1-3H3,(H,11,13);1H.
What are the key properties of N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen?
N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen has a molecular weight of 214.33 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide;molecular hydrogen is sourced from PubChem (CID 176998106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).