2-N-thiophen-3-ylpyridine-2,3-diamine

C9H9N3S — CID 66349916

IUPAC2-N-thiophen-3-ylpyridine-2,3-diamine
SMILESNc1cccnc1Nc1ccsc1
InChIInChI=1S/C9H9N3S/c10-8-2-1-4-11-9(8)12-7-3-5-13-6-7/h1-6H,10H2,(H,11,12)
InChIKeyFSZRPNXBHSVCRH-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.47
Rot. Bonds2

About 2-N-thiophen-3-ylpyridine-2,3-diamine

2-N-thiophen-3-ylpyridine-2,3-diamine (PubChem CID 66349916) has the molecular formula C9H9N3S and a molecular weight of 191.26 g/mol. Its IUPAC name is 2-N-thiophen-3-ylpyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-thiophen-3-ylpyridine-2,3-diamine
PubChem CID66349916
Molecular FormulaC9H9N3S
Molecular Weight191.26 g/mol
Exact Mass191.05
IUPAC Name2-N-thiophen-3-ylpyridine-2,3-diamine
SMILESNc1cccnc1Nc1ccsc1
InChIInChI=1S/C9H9N3S/c10-8-2-1-4-11-9(8)12-7-3-5-13-6-7/h1-6H,10H2,(H,11,12)
InChIKeyFSZRPNXBHSVCRH-UHFFFAOYSA-N
XLogP2.47
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N-thiophen-3-ylpyridine-2,3-diamine?
The IUPAC name of 2-N-thiophen-3-ylpyridine-2,3-diamine (CID 66349916) is 2-N-thiophen-3-ylpyridine-2,3-diamine.
What is the SMILES notation for 2-N-thiophen-3-ylpyridine-2,3-diamine?
The canonical SMILES for 2-N-thiophen-3-ylpyridine-2,3-diamine is Nc1cccnc1Nc1ccsc1.
What is the InChIKey of 2-N-thiophen-3-ylpyridine-2,3-diamine?
The InChIKey is FSZRPNXBHSVCRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3S/c10-8-2-1-4-11-9(8)12-7-3-5-13-6-7/h1-6H,10H2,(H,11,12).
What are the key properties of 2-N-thiophen-3-ylpyridine-2,3-diamine?
2-N-thiophen-3-ylpyridine-2,3-diamine has a molecular weight of 191.26 g/mol, XLogP of 2.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-thiophen-3-ylpyridine-2,3-diamine is sourced from PubChem (CID 66349916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).