2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide

C12H19N3OS — CID 119887402

IUPAC2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide
SMILESCNCC(=O)NC1(c2nc(C)cs2)CCCC1
InChIInChI=1S/C12H19N3OS/c1-9-8-17-11(14-9)12(5-3-4-6-12)15-10(16)7-13-2/h8,13H,3-7H2,1-2H3,(H,15,16)
InChIKeyWCZVFKKKYDOKLR-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.56
Rot. Bonds4

About 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide

2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide (PubChem CID 119887402) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide
PubChem CID119887402
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC Name2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide
SMILESCNCC(=O)NC1(c2nc(C)cs2)CCCC1
InChIInChI=1S/C12H19N3OS/c1-9-8-17-11(14-9)12(5-3-4-6-12)15-10(16)7-13-2/h8,13H,3-7H2,1-2H3,(H,15,16)
InChIKeyWCZVFKKKYDOKLR-UHFFFAOYSA-N
XLogP1.56
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide?
The IUPAC name of 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide (CID 119887402) is 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide.
What is the SMILES notation for 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide?
The canonical SMILES for 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide is CNCC(=O)NC1(c2nc(C)cs2)CCCC1.
What is the InChIKey of 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide?
The InChIKey is WCZVFKKKYDOKLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-9-8-17-11(14-9)12(5-3-4-6-12)15-10(16)7-13-2/h8,13H,3-7H2,1-2H3,(H,15,16).
What are the key properties of 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide?
2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide has a molecular weight of 253.37 g/mol, XLogP of 1.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide is sourced from PubChem (CID 119887402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).