N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide

C10H11N3O2S — CID 7064095

IUPACN-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc(-c2csc(N)n2)o1
InChIInChI=1S/C10H11N3O2S/c1-6(14)12-4-7-2-3-9(15-7)8-5-16-10(11)13-8/h2-3,5H,4H2,1H3,(H2,11,13)(H,12,14)
InChIKeyHMOORGLQDZENJJ-UHFFFAOYSA-N
MW237.28 g/mol
LogP1.62
Rot. Bonds3

About N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide

N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide (PubChem CID 7064095) has the molecular formula C10H11N3O2S and a molecular weight of 237.28 g/mol. Its IUPAC name is N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide
PubChem CID7064095
Molecular FormulaC10H11N3O2S
Molecular Weight237.28 g/mol
Exact Mass237.06
IUPAC NameN-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc(-c2csc(N)n2)o1
InChIInChI=1S/C10H11N3O2S/c1-6(14)12-4-7-2-3-9(15-7)8-5-16-10(11)13-8/h2-3,5H,4H2,1H3,(H2,11,13)(H,12,14)
InChIKeyHMOORGLQDZENJJ-UHFFFAOYSA-N
XLogP1.62
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide?
The IUPAC name of N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide (CID 7064095) is N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide?
The canonical SMILES for N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide is CC(=O)NCc1ccc(-c2csc(N)n2)o1.
What is the InChIKey of N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide?
The InChIKey is HMOORGLQDZENJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2S/c1-6(14)12-4-7-2-3-9(15-7)8-5-16-10(11)13-8/h2-3,5H,4H2,1H3,(H2,11,13)(H,12,14).
What are the key properties of N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide?
N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide has a molecular weight of 237.28 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2-amino-1,3-thiazol-4-yl)furan-2-yl]methyl]acetamide is sourced from PubChem (CID 7064095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).