2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide

C15H23N3OS — CID 103064734

IUPAC2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NC2CCSC2)cc(CC)n1
InChIInChI=1S/C15H23N3OS/c1-3-6-16-14-9-11(8-12(4-2)17-14)15(19)18-13-5-7-20-10-13/h8-9,13H,3-7,10H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyMOSZABXADYISOI-UHFFFAOYSA-N
MW293.44 g/mol
LogP2.70
Rot. Bonds6

About 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide

2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide (PubChem CID 103064734) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide
PubChem CID103064734
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC Name2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NC2CCSC2)cc(CC)n1
InChIInChI=1S/C15H23N3OS/c1-3-6-16-14-9-11(8-12(4-2)17-14)15(19)18-13-5-7-20-10-13/h8-9,13H,3-7,10H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyMOSZABXADYISOI-UHFFFAOYSA-N
XLogP2.70
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-6-propyl-N-(thiolan-3-yl)pyridine-4-carboxamide
CID 103064748
2-ethyl-N-(5-oxopyrrolidin-3-yl)-6-(propylamino)pyridine-4-carboxamide
CID 106197807
N,2-diethyl-6-(propylamino)pyridine-4-carboxamide
CID 113380952
3-chloro-6-(propylamino)-N-(thiolan-3-yl)pyridine-2-carboxamide
CID 103064677
2-chloro-6-(propylamino)-N-(thiolan-3-ylmethyl)pyridine-4-carboxamide
CID 107298139
3-nitro-4-(propylamino)-N-(thiolan-3-yl)benzamide
CID 103064692
2-(1,4-dithian-2-ylmethylamino)-6-ethylpyridine-4-carboxylic acid
CID 113489440
2-(1,4-dithian-2-yl)-6-ethyl-N-propylpyrimidin-4-amine
CID 79966267
3-amino-5-methoxy-N-(thiolan-3-yl)benzamide
CID 103062202
2-ethyl-N-(1,2-oxazol-5-ylmethyl)-6-(propylamino)pyridine-4-carboxamide
CID 106423091
N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide
CID 123798509
4-(bromomethyl)-N-(thiolan-3-yl)benzamide
CID 103062722

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide?
The IUPAC name of 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide (CID 103064734) is 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide is CCCNc1cc(C(=O)NC2CCSC2)cc(CC)n1.
What is the InChIKey of 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide?
The InChIKey is MOSZABXADYISOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3OS/c1-3-6-16-14-9-11(8-12(4-2)17-14)15(19)18-13-5-7-20-10-13/h8-9,13H,3-7,10H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide?
2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide has a molecular weight of 293.44 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(propylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 103064734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).