N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide

C19H20N4OS — CID 170054577

IUPACN-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide
SMILESCc1ccccc1-c1ccc2nc(NC(=O)N3CCCCC3)sc2n1
InChIInChI=1S/C19H20N4OS/c1-13-7-3-4-8-14(13)15-9-10-16-17(20-15)25-18(21-16)22-19(24)23-11-5-2-6-12-23/h3-4,7-10H,2,5-6,11-12H2,1H3,(H,21,22,24)
InChIKeyXHPODPQZNXCVOH-UHFFFAOYSA-N
MW352.46 g/mol
LogP4.68
Rot. Bonds2

About N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide

N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide (PubChem CID 170054577) has the molecular formula C19H20N4OS and a molecular weight of 352.46 g/mol. Its IUPAC name is N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide
PubChem CID170054577
Molecular FormulaC19H20N4OS
Molecular Weight352.46 g/mol
Exact Mass352.14
IUPAC NameN-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide
SMILESCc1ccccc1-c1ccc2nc(NC(=O)N3CCCCC3)sc2n1
InChIInChI=1S/C19H20N4OS/c1-13-7-3-4-8-14(13)15-9-10-16-17(20-15)25-18(21-16)22-19(24)23-11-5-2-6-12-23/h3-4,7-10H,2,5-6,11-12H2,1H3,(H,21,22,24)
InChIKeyXHPODPQZNXCVOH-UHFFFAOYSA-N
XLogP4.68
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-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 N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide?
The IUPAC name of N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide (CID 170054577) is N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide.
What is the SMILES notation for N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide?
The canonical SMILES for N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide is Cc1ccccc1-c1ccc2nc(NC(=O)N3CCCCC3)sc2n1.
What is the InChIKey of N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide?
The InChIKey is XHPODPQZNXCVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4OS/c1-13-7-3-4-8-14(13)15-9-10-16-17(20-15)25-18(21-16)22-19(24)23-11-5-2-6-12-23/h3-4,7-10H,2,5-6,11-12H2,1H3,(H,21,22,24).
What are the key properties of N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide?
N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide has a molecular weight of 352.46 g/mol, XLogP of 4.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-methylphenyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-1-carboxamide is sourced from PubChem (CID 170054577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).