6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide

C11H17N3OS — CID 115753164

IUPAC6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide
SMILESCSC(C)(C)CNC(=O)c1cccc(N)n1
InChIInChI=1S/C11H17N3OS/c1-11(2,16-3)7-13-10(15)8-5-4-6-9(12)14-8/h4-6H,7H2,1-3H3,(H2,12,14)(H,13,15)
InChIKeyJGOZAWQFQVMGHD-UHFFFAOYSA-N
MW239.34 g/mol
LogP1.54
Rot. Bonds4

About 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide

6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide (PubChem CID 115753164) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide
PubChem CID115753164
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide
SMILESCSC(C)(C)CNC(=O)c1cccc(N)n1
InChIInChI=1S/C11H17N3OS/c1-11(2,16-3)7-13-10(15)8-5-4-6-9(12)14-8/h4-6H,7H2,1-3H3,(H2,12,14)(H,13,15)
InChIKeyJGOZAWQFQVMGHD-UHFFFAOYSA-N
XLogP1.54
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-(2-ethyl-2-methylsulfanylbutyl)pyridine-2-carboxamide
CID 103832168
6-amino-N-(2-methyl-3-methylsulfanylpropyl)pyridine-2-carboxamide
CID 63962957
6-amino-N-(5-methylsulfanylpentyl)pyridine-2-carboxamide
CID 114129261
6-amino-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide
CID 71114856
6-amino-N-[2-(ethylamino)-2-oxoethyl]pyridine-2-carboxamide
CID 62238608
6-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 62240593
5-hydrazinyl-N-(2-methyl-2-methylsulfanylpropyl)pyrazine-2-carboxamide
CID 107378643
6-amino-N-benzylpyridine-2-carboxamide
CID 62240949
4-(aminomethyl)-N-(2-methyl-2-methylsulfanylpropyl)benzamide
CID 115734394
6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 62238827
N-[(2R)-2-hydroxy-2-methyl-3-methylsulfanylpropyl]-6-methylpyridine-2-carboxamide
CID 95773940
6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide
CID 62239244

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide (CID 115753164) is 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide is CSC(C)(C)CNC(=O)c1cccc(N)n1.
What is the InChIKey of 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide?
The InChIKey is JGOZAWQFQVMGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-11(2,16-3)7-13-10(15)8-5-4-6-9(12)14-8/h4-6H,7H2,1-3H3,(H2,12,14)(H,13,15).
What are the key properties of 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide?
6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide has a molecular weight of 239.34 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-methyl-2-methylsulfanylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 115753164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).