N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide

C15H19N3O2S — CID 164879336

IUPACN-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ncc(C3CCC(C)C3)s2)on1
InChIInChI=1S/C15H19N3O2S/c1-9-3-4-11(5-9)13-8-16-15(21-13)17-14(19)7-12-6-10(2)18-20-12/h6,8-9,11H,3-5,7H2,1-2H3,(H,16,17,19)
InChIKeyGCROEYVKVWMKBK-UHFFFAOYSA-N
MW305.40 g/mol
LogP3.52
Rot. Bonds4

About N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide

N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide (PubChem CID 164879336) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide.

Molecular Properties

Compound NameN-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
PubChem CID164879336
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ncc(C3CCC(C)C3)s2)on1
InChIInChI=1S/C15H19N3O2S/c1-9-3-4-11(5-9)13-8-16-15(21-13)17-14(19)7-12-6-10(2)18-20-12/h6,8-9,11H,3-5,7H2,1-2H3,(H,16,17,19)
InChIKeyGCROEYVKVWMKBK-UHFFFAOYSA-N
XLogP3.52
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide?
The IUPAC name of N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide (CID 164879336) is N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide.
What is the SMILES notation for N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide?
The canonical SMILES for N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide is Cc1cc(CC(=O)Nc2ncc(C3CCC(C)C3)s2)on1.
What is the InChIKey of N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide?
The InChIKey is GCROEYVKVWMKBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-9-3-4-11(5-9)13-8-16-15(21-13)17-14(19)7-12-6-10(2)18-20-12/h6,8-9,11H,3-5,7H2,1-2H3,(H,16,17,19).
What are the key properties of N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide?
N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide has a molecular weight of 305.40 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-methylcyclopentyl)-1,3-thiazol-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide is sourced from PubChem (CID 164879336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).