6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide

C10H12ClN3OS — CID 103064660

IUPAC6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide
SMILESNc1ccc(Cl)c(C(=O)NC2CCSC2)n1
InChIInChI=1S/C10H12ClN3OS/c11-7-1-2-8(12)14-9(7)10(15)13-6-3-4-16-5-6/h1-2,6H,3-5H2,(H2,12,14)(H,13,15)
InChIKeyOYHDNRZMOMRPEF-UHFFFAOYSA-N
MW257.75 g/mol
LogP1.55
Rot. Bonds2

About 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide

6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide (PubChem CID 103064660) has the molecular formula C10H12ClN3OS and a molecular weight of 257.75 g/mol. Its IUPAC name is 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide
PubChem CID103064660
Molecular FormulaC10H12ClN3OS
Molecular Weight257.75 g/mol
Exact Mass257.04
IUPAC Name6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide
SMILESNc1ccc(Cl)c(C(=O)NC2CCSC2)n1
InChIInChI=1S/C10H12ClN3OS/c11-7-1-2-8(12)14-9(7)10(15)13-6-3-4-16-5-6/h1-2,6H,3-5H2,(H2,12,14)(H,13,15)
InChIKeyOYHDNRZMOMRPEF-UHFFFAOYSA-N
XLogP1.55
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.75
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-6-(propylamino)-N-(thiolan-3-yl)pyridine-2-carboxamide
CID 103064677
6-amino-3-chloro-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 62155799
6-amino-3-chloro-N-(3-methylcyclopentyl)pyridine-2-carboxamide
CID 114540527
5-amino-2-chloro-N-(thiolan-3-yl)benzamide
CID 103062189
6-amino-3-chloro-N-(2-hydroxycyclohexyl)pyridine-2-carboxamide
CID 62358573
2-amino-6-chloro-N-(thiolan-3-yl)benzamide
CID 103062170
6-amino-3-chloro-N-methylpyridine-2-carboxamide
CID 62156050
6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide
CID 79873055
4-amino-N-(thiolan-3-yl)pyridine-2-carboxamide
CID 103064661
6-amino-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154853
3-chloro-N-cyclobutyl-6-(methylamino)pyridine-2-carboxamide
CID 62415036
2-amino-N-(thiolan-3-yl)-1,3-benzothiazole-6-carboxamide
CID 103063030

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide (CID 103064660) is 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide is Nc1ccc(Cl)c(C(=O)NC2CCSC2)n1.
What is the InChIKey of 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide?
The InChIKey is OYHDNRZMOMRPEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3OS/c11-7-1-2-8(12)14-9(7)10(15)13-6-3-4-16-5-6/h1-2,6H,3-5H2,(H2,12,14)(H,13,15).
What are the key properties of 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide?
6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide has a molecular weight of 257.75 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 103064660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).