N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide

C14H19N3O2S — CID 120831629

IUPACN-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide
SMILESCNC(C)CNC(=O)Cc1csc(-c2ccc(C)o2)n1
InChIInChI=1S/C14H19N3O2S/c1-9(15-3)7-16-13(18)6-11-8-20-14(17-11)12-5-4-10(2)19-12/h4-5,8-9,15H,6-7H2,1-3H3,(H,16,18)
InChIKeyZJZOANKBNKJTTK-UHFFFAOYSA-N
MW293.39 g/mol
LogP1.98
Rot. Bonds6

About N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide

N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide (PubChem CID 120831629) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide.

Molecular Properties

Compound NameN-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide
PubChem CID120831629
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC NameN-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide
SMILESCNC(C)CNC(=O)Cc1csc(-c2ccc(C)o2)n1
InChIInChI=1S/C14H19N3O2S/c1-9(15-3)7-16-13(18)6-11-8-20-14(17-11)12-5-4-10(2)19-12/h4-5,8-9,15H,6-7H2,1-3H3,(H,16,18)
InChIKeyZJZOANKBNKJTTK-UHFFFAOYSA-N
XLogP1.98
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide?
The IUPAC name of N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide (CID 120831629) is N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide.
What is the SMILES notation for N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide?
The canonical SMILES for N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide is CNC(C)CNC(=O)Cc1csc(-c2ccc(C)o2)n1.
What is the InChIKey of N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide?
The InChIKey is ZJZOANKBNKJTTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c1-9(15-3)7-16-13(18)6-11-8-20-14(17-11)12-5-4-10(2)19-12/h4-5,8-9,15H,6-7H2,1-3H3,(H,16,18).
What are the key properties of N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide?
N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide has a molecular weight of 293.39 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)propyl]-2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetamide is sourced from PubChem (CID 120831629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).