4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide

C17H21N3O2S — CID 118613050

IUPAC4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide
SMILESCc1cc(OC2CCCCC2)cc(C(=O)Nc2nc(C)cs2)n1
InChIInChI=1S/C17H21N3O2S/c1-11-8-14(22-13-6-4-3-5-7-13)9-15(18-11)16(21)20-17-19-12(2)10-23-17/h8-10,13H,3-7H2,1-2H3,(H,19,20,21)
InChIKeyMKDGMAIPYNTPKD-UHFFFAOYSA-N
MW331.44 g/mol
LogP4.12
Rot. Bonds4

About 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide

4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide (PubChem CID 118613050) has the molecular formula C17H21N3O2S and a molecular weight of 331.44 g/mol. Its IUPAC name is 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide
PubChem CID118613050
Molecular FormulaC17H21N3O2S
Molecular Weight331.44 g/mol
Exact Mass331.14
IUPAC Name4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide
SMILESCc1cc(OC2CCCCC2)cc(C(=O)Nc2nc(C)cs2)n1
InChIInChI=1S/C17H21N3O2S/c1-11-8-14(22-13-6-4-3-5-7-13)9-15(18-11)16(21)20-17-19-12(2)10-23-17/h8-10,13H,3-7H2,1-2H3,(H,19,20,21)
InChIKeyMKDGMAIPYNTPKD-UHFFFAOYSA-N
XLogP4.12
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.44
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide 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 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide (CID 118613050) is 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide is Cc1cc(OC2CCCCC2)cc(C(=O)Nc2nc(C)cs2)n1.
What is the InChIKey of 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide?
The InChIKey is MKDGMAIPYNTPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2S/c1-11-8-14(22-13-6-4-3-5-7-13)9-15(18-11)16(21)20-17-19-12(2)10-23-17/h8-10,13H,3-7H2,1-2H3,(H,19,20,21).
What are the key properties of 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide?
4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide has a molecular weight of 331.44 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyloxy-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 118613050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).