5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide

C14H16ClN3OS — CID 133356764

IUPAC5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide
SMILESCC(Cc1ccsc1)N(C)c1ncc(C(N)=O)cc1Cl
InChIInChI=1S/C14H16ClN3OS/c1-9(5-10-3-4-20-8-10)18(2)14-12(15)6-11(7-17-14)13(16)19/h3-4,6-9H,5H2,1-2H3,(H2,16,19)
InChIKeyPRAJSBFVIRUCBH-UHFFFAOYSA-N
MW309.82 g/mol
LogP2.96
Rot. Bonds5

About 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide

5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide (PubChem CID 133356764) has the molecular formula C14H16ClN3OS and a molecular weight of 309.82 g/mol. Its IUPAC name is 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide
PubChem CID133356764
Molecular FormulaC14H16ClN3OS
Molecular Weight309.82 g/mol
Exact Mass309.07
IUPAC Name5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide
SMILESCC(Cc1ccsc1)N(C)c1ncc(C(N)=O)cc1Cl
InChIInChI=1S/C14H16ClN3OS/c1-9(5-10-3-4-20-8-10)18(2)14-12(15)6-11(7-17-14)13(16)19/h3-4,6-9H,5H2,1-2H3,(H2,16,19)
InChIKeyPRAJSBFVIRUCBH-UHFFFAOYSA-N
XLogP2.96
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.82
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5,6-dichloro-N-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 43396646
5-[methyl-[(2S)-1-thiophen-3-ylpropan-2-yl]carbamoyl]pyridine-2-carboxylic acid
CID 129414965
2-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carbonitrile
CID 133356712
5-chloro-6-hydrazinyl-N-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 62243030
6-[2-(4-bromophenyl)ethyl-methylamino]-5-chloropyridine-3-carboxamide
CID 133292141
N-methyl-N-(1-thiophen-3-ylpropan-2-yl)-7H-purin-6-amine
CID 84591411
N-methyl-5-nitro-N-(1-thiophen-3-ylpropan-2-yl)pyridin-2-amine
CID 133356717
5-chloro-6-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]pyridine-3-carboxamide
CID 133294145
5-carbamothioyl-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-carboxamide
CID 63748666
2-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-4-carboxamide
CID 114923012
5-chloro-6-[cyclopentylmethyl(methyl)amino]pyridine-3-carboxamide
CID 75418381
2-[ethyl(1-thiophen-3-ylpropan-2-yl)carbamoyl]pyridine-4-carboxylic acid
CID 122056280

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide (CID 133356764) is 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide is CC(Cc1ccsc1)N(C)c1ncc(C(N)=O)cc1Cl.
What is the InChIKey of 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide?
The InChIKey is PRAJSBFVIRUCBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3OS/c1-9(5-10-3-4-20-8-10)18(2)14-12(15)6-11(7-17-14)13(16)19/h3-4,6-9H,5H2,1-2H3,(H2,16,19).
What are the key properties of 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide?
5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide has a molecular weight of 309.82 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 133356764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).