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

C13H16N4OS — CID 55042843

IUPACN-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2ncc(C)s2)ccn1
InChIInChI=1S/C13H16N4OS/c1-3-5-14-11-7-10(4-6-15-11)12(18)17-13-16-8-9(2)19-13/h4,6-8H,3,5H2,1-2H3,(H,14,15)(H,16,17,18)
InChIKeyRDAMZDDSPSEUAE-UHFFFAOYSA-N
MW276.37 g/mol
LogP2.92
Rot. Bonds5

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

N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 55042843) has the molecular formula C13H16N4OS and a molecular weight of 276.37 g/mol. Its IUPAC name is N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID55042843
Molecular FormulaC13H16N4OS
Molecular Weight276.37 g/mol
Exact Mass276.10
IUPAC NameN-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2ncc(C)s2)ccn1
InChIInChI=1S/C13H16N4OS/c1-3-5-14-11-7-10(4-6-15-11)12(18)17-13-16-8-9(2)19-13/h4,6-8H,3,5H2,1-2H3,(H,14,15)(H,16,17,18)
InChIKeyRDAMZDDSPSEUAE-UHFFFAOYSA-N
XLogP2.92
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.37
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-N-(5-methyl-1,3-thiazol-2-yl)-4-(propylamino)benzamide
CID 63210151
N-(2,6-dimethylphenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62165900
N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 62170975
N-(3-methyl-4-pyridinyl)-2-(propylamino)pyridine-4-carboxamide
CID 63670386
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide
CID 62178983
N-(3-methylphenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62172134
N-(3-fluorophenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62166192
4-(ethylamino)-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 63210150
N-butyl-2-(propylamino)pyridine-4-carboxamide
CID 62185279
N-(5-methyl-1,3-thiazol-2-yl)-3-(propylsulfamoyl)benzamide
CID 17484062
N-(2-chloro-6-methylphenyl)-2-(propylamino)pyridine-4-carboxamide
CID 66254887
4-(ethylamino)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 62165674

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide (CID 55042843) is N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)Nc2ncc(C)s2)ccn1.
What is the InChIKey of N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is RDAMZDDSPSEUAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4OS/c1-3-5-14-11-7-10(4-6-15-11)12(18)17-13-16-8-9(2)19-13/h4,6-8H,3,5H2,1-2H3,(H,14,15)(H,16,17,18).
What are the key properties of N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide?
N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 276.37 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 55042843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).