N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide

C11H16N2OS — CID 121122773

IUPACN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide
SMILESCc1nc(C)c(CNC(=O)C2CCC2)s1
InChIInChI=1S/C11H16N2OS/c1-7-10(15-8(2)13-7)6-12-11(14)9-4-3-5-9/h9H,3-6H2,1-2H3,(H,12,14)
InChIKeyLZRBGUYOAOAKQQ-UHFFFAOYSA-N
MW224.33 g/mol
LogP2.18
Rot. Bonds3

About N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide

N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide (PubChem CID 121122773) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide
PubChem CID121122773
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC NameN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide
SMILESCc1nc(C)c(CNC(=O)C2CCC2)s1
InChIInChI=1S/C11H16N2OS/c1-7-10(15-8(2)13-7)6-12-11(14)9-4-3-5-9/h9H,3-6H2,1-2H3,(H,12,14)
InChIKeyLZRBGUYOAOAKQQ-UHFFFAOYSA-N
XLogP2.18
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide?
The IUPAC name of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide (CID 121122773) is N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide?
The canonical SMILES for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide is Cc1nc(C)c(CNC(=O)C2CCC2)s1.
What is the InChIKey of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide?
The InChIKey is LZRBGUYOAOAKQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c1-7-10(15-8(2)13-7)6-12-11(14)9-4-3-5-9/h9H,3-6H2,1-2H3,(H,12,14).
What are the key properties of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide?
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide has a molecular weight of 224.33 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclobutanecarboxamide is sourced from PubChem (CID 121122773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).