5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide

C10H14N4OS — CID 103062322

IUPAC5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)cnc1NC1CCSC1
InChIInChI=1S/C10H14N4OS/c11-6-3-8(9(12)15)10(13-4-6)14-7-1-2-16-5-7/h3-4,7H,1-2,5,11H2,(H2,12,15)(H,13,14)
InChIKeyDOMDEXGCGRMAAW-UHFFFAOYSA-N
MW238.32 g/mol
LogP0.68
Rot. Bonds3

About 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide

5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide (PubChem CID 103062322) has the molecular formula C10H14N4OS and a molecular weight of 238.32 g/mol. Its IUPAC name is 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide
PubChem CID103062322
Molecular FormulaC10H14N4OS
Molecular Weight238.32 g/mol
Exact Mass238.09
IUPAC Name5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)cnc1NC1CCSC1
InChIInChI=1S/C10H14N4OS/c11-6-3-8(9(12)15)10(13-4-6)14-7-1-2-16-5-7/h3-4,7H,1-2,5,11H2,(H2,12,15)(H,13,14)
InChIKeyDOMDEXGCGRMAAW-UHFFFAOYSA-N
XLogP0.68
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.32
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide (CID 103062322) is 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide is NC(=O)c1cc(N)cnc1NC1CCSC1.
What is the InChIKey of 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide?
The InChIKey is DOMDEXGCGRMAAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4OS/c11-6-3-8(9(12)15)10(13-4-6)14-7-1-2-16-5-7/h3-4,7H,1-2,5,11H2,(H2,12,15)(H,13,14).
What are the key properties of 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide?
5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide has a molecular weight of 238.32 g/mol, XLogP of 0.68, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 103062322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).