5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile

C10H10FN3S — CID 129348328

IUPAC5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile
SMILESN#Cc1cnc(N[C@@H]2CCSC2)c(F)c1
InChIInChI=1S/C10H10FN3S/c11-9-3-7(4-12)5-13-10(9)14-8-1-2-15-6-8/h3,5,8H,1-2,6H2,(H,13,14)/t8-/m1/s1
InChIKeyHXZQIKIBBNHXCU-MRVPVSSYSA-N
MW223.28 g/mol
LogP2.01
Rot. Bonds2

About 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile

5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile (PubChem CID 129348328) has the molecular formula C10H10FN3S and a molecular weight of 223.28 g/mol. Its IUPAC name is 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile
PubChem CID129348328
Molecular FormulaC10H10FN3S
Molecular Weight223.28 g/mol
Exact Mass223.06
IUPAC Name5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile
SMILESN#Cc1cnc(N[C@@H]2CCSC2)c(F)c1
InChIInChI=1S/C10H10FN3S/c11-9-3-7(4-12)5-13-10(9)14-8-1-2-15-6-8/h3,5,8H,1-2,6H2,(H,13,14)/t8-/m1/s1
InChIKeyHXZQIKIBBNHXCU-MRVPVSSYSA-N
XLogP2.01
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-2-(thiolan-3-ylamino)pyridine-3-carbonitrile
CID 103062320
4-N-(thiolan-3-yl)pyrimidine-4,5-diamine
CID 103062457
5-amino-2-(thiolan-3-ylamino)pyridine-3-carboxamide
CID 103062322
6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoropyridine-3-carbonitrile
CID 141152908
2-fluoro-5-(thian-3-ylamino)benzonitrile
CID 62872546
5-bromo-2-methyl-N-(thiolan-3-yl)pyrimidin-4-amine
CID 130703562
3-nitro-2-(thiolan-3-ylamino)pyridine-4-carbonitrile
CID 103764758
5-fluoro-6-[[1-(2-fluorophenyl)cyclopropyl]amino]pyridine-3-carbonitrile
CID 175751562
3-chloro-N-(thiolan-3-yl)pyrazin-2-amine
CID 103064284
6-N,5-diethyl-4-N-(thiolan-3-yl)pyrimidine-4,6-diamine
CID 103065273
3-methyl-5-nitro-N-(thiolan-3-yl)pyridin-2-amine
CID 103704257
6-methyl-2-(thiolan-3-ylamino)pyrimidine-4-carbonitrile
CID 107545432

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile?
The IUPAC name of 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile (CID 129348328) is 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile.
What is the SMILES notation for 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile?
The canonical SMILES for 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile is N#Cc1cnc(N[C@@H]2CCSC2)c(F)c1.
What is the InChIKey of 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile?
The InChIKey is HXZQIKIBBNHXCU-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H10FN3S/c11-9-3-7(4-12)5-13-10(9)14-8-1-2-15-6-8/h3,5,8H,1-2,6H2,(H,13,14)/t8-/m1/s1.
What are the key properties of 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile?
5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile has a molecular weight of 223.28 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-[[(3R)-thiolan-3-yl]amino]pyridine-3-carbonitrile is sourced from PubChem (CID 129348328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).