6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide

C19H26N6OS — CID 133339180

IUPAC6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
SMILESO=C(Nc1nncs1)c1ccc(NC2CCCN(C3CCCCC3)C2)nc1
InChIInChI=1S/C19H26N6OS/c26-18(23-19-24-21-13-27-19)14-8-9-17(20-11-14)22-15-5-4-10-25(12-15)16-6-2-1-3-7-16/h8-9,11,13,15-16H,1-7,10,12H2,(H,20,22)(H,23,24,26)
InChIKeyGMOMIQDYRZPIIN-UHFFFAOYSA-N
MW386.53 g/mol
LogP3.39
Rot. Bonds5

About 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide

6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide (PubChem CID 133339180) has the molecular formula C19H26N6OS and a molecular weight of 386.53 g/mol. Its IUPAC name is 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
PubChem CID133339180
Molecular FormulaC19H26N6OS
Molecular Weight386.53 g/mol
Exact Mass386.19
IUPAC Name6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
SMILESO=C(Nc1nncs1)c1ccc(NC2CCCN(C3CCCCC3)C2)nc1
InChIInChI=1S/C19H26N6OS/c26-18(23-19-24-21-13-27-19)14-8-9-17(20-11-14)22-15-5-4-10-25(12-15)16-6-2-1-3-7-16/h8-9,11,13,15-16H,1-7,10,12H2,(H,20,22)(H,23,24,26)
InChIKeyGMOMIQDYRZPIIN-UHFFFAOYSA-N
XLogP3.39
TPSA83.04 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.53
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-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 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide (CID 133339180) is 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide is O=C(Nc1nncs1)c1ccc(NC2CCCN(C3CCCCC3)C2)nc1.
What is the InChIKey of 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is GMOMIQDYRZPIIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6OS/c26-18(23-19-24-21-13-27-19)14-8-9-17(20-11-14)22-15-5-4-10-25(12-15)16-6-2-1-3-7-16/h8-9,11,13,15-16H,1-7,10,12H2,(H,20,22)(H,23,24,26).
What are the key properties of 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide?
6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 386.53 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-cyclohexylpiperidin-3-yl)amino]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 133339180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).