5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide

C14H17ClN4OS — CID 114923156

IUPAC5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2nc(C)c(C)s2)c(Cl)cn1
InChIInChI=1S/C14H17ClN4OS/c1-4-5-16-12-6-10(11(15)7-17-12)13(20)19-14-18-8(2)9(3)21-14/h6-7H,4-5H2,1-3H3,(H,16,17)(H,18,19,20)
InChIKeyVGASDIOAECJDMK-UHFFFAOYSA-N
MW324.84 g/mol
LogP3.88
Rot. Bonds5

About 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide

5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 114923156) has the molecular formula C14H17ClN4OS and a molecular weight of 324.84 g/mol. Its IUPAC name is 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID114923156
Molecular FormulaC14H17ClN4OS
Molecular Weight324.84 g/mol
Exact Mass324.08
IUPAC Name5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2nc(C)c(C)s2)c(Cl)cn1
InChIInChI=1S/C14H17ClN4OS/c1-4-5-16-12-6-10(11(15)7-17-12)13(20)19-14-18-8(2)9(3)21-14/h6-7H,4-5H2,1-3H3,(H,16,17)(H,18,19,20)
InChIKeyVGASDIOAECJDMK-UHFFFAOYSA-N
XLogP3.88
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.84
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(ethylamino)pyridine-4-carboxamide
CID 114923155
5-chloro-N-(5-methyl-2-pyridinyl)-2-(propylamino)pyridine-4-carboxamide
CID 114921617
5-chloro-N-(3-methylpentan-3-yl)-2-(propylamino)pyridine-4-carboxamide
CID 106331340
5-chloro-2-(propylamino)-N-(2-sulfamoylethyl)pyridine-4-carboxamide
CID 114922305
2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-5-sulfanylbenzamide
CID 107024982
N-(3-bromo-4-pyridinyl)-5-chloro-2-(propylamino)pyridine-4-carboxamide
CID 114924258
5-chloro-N-(3-methylpentan-2-yl)-2-(propylamino)pyridine-4-carboxamide
CID 114922662
4-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 81226435
N-(3-amino-2,2-dimethyl-3-oxopropyl)-5-chloro-2-(propylamino)pyridine-4-carboxamide
CID 106280116
5-chloro-N-[2-(2-methoxyethoxy)ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 114922629
N-(5-amino-5-oxopentyl)-5-chloro-2-(propylamino)pyridine-4-carboxamide
CID 106241124
5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide
CID 114924077

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide (CID 114923156) is 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)Nc2nc(C)c(C)s2)c(Cl)cn1.
What is the InChIKey of 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is VGASDIOAECJDMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4OS/c1-4-5-16-12-6-10(11(15)7-17-12)13(20)19-14-18-8(2)9(3)21-14/h6-7H,4-5H2,1-3H3,(H,16,17)(H,18,19,20).
What are the key properties of 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide?
5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 324.84 g/mol, XLogP of 3.88, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 114923156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).