2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide

C14H17N3OS — CID 78962887

IUPAC2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide
SMILESCC(C)(CNc1ncccc1C(N)=O)c1cccs1
InChIInChI=1S/C14H17N3OS/c1-14(2,11-6-4-8-19-11)9-17-13-10(12(15)18)5-3-7-16-13/h3-8H,9H2,1-2H3,(H2,15,18)(H,16,17)
InChIKeyNSRDWTDENJWTJD-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.63
Rot. Bonds5

About 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide

2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide (PubChem CID 78962887) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide
PubChem CID78962887
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide
SMILESCC(C)(CNc1ncccc1C(N)=O)c1cccs1
InChIInChI=1S/C14H17N3OS/c1-14(2,11-6-4-8-19-11)9-17-13-10(12(15)18)5-3-7-16-13/h3-8H,9H2,1-2H3,(H2,15,18)(H,16,17)
InChIKeyNSRDWTDENJWTJD-UHFFFAOYSA-N
XLogP2.63
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridin-2-amine
CID 80528214
3-amino-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-2-carboxamide
CID 104742615
2-[[2,2-dimethyl-3-(methylamino)-3-oxopropyl]amino]pyridine-3-carboxamide
CID 113278138
2-[[2-ethyl-2-(hydroxymethyl)butyl]amino]pyridine-3-carboxamide
CID 113334693
2-(methylamino)-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-sulfonamide
CID 80524392
3-fluoro-2-(methylamino)-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-4-carboxamide
CID 105386960
3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 79099370
5-chloro-6-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxylic acid
CID 80528307
2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine
CID 103437186
5-bromo-N-(2-methyl-2-thiophen-2-ylpropyl)isoquinolin-1-amine
CID 106539136
2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyrimidine-4-carboxylic acid
CID 107554215
2-(butylamino)pyridine-3-carboxamide
CID 29031037

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide?
The IUPAC name of 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide (CID 78962887) is 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide is CC(C)(CNc1ncccc1C(N)=O)c1cccs1.
What is the InChIKey of 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide?
The InChIKey is NSRDWTDENJWTJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-14(2,11-6-4-8-19-11)9-17-13-10(12(15)18)5-3-7-16-13/h3-8H,9H2,1-2H3,(H2,15,18)(H,16,17).
What are the key properties of 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide?
2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide has a molecular weight of 275.38 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 78962887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).