N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine

C7H5ClN2OS — CID 144620136

IUPACN-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine
SMILESONc1cnc2ccsc2c1Cl
InChIInChI=1S/C7H5ClN2OS/c8-6-5(10-11)3-9-4-1-2-12-7(4)6/h1-3,10-11H
InChIKeyRWUBBRSRZBHQFA-UHFFFAOYSA-N
MW200.65 g/mol
LogP2.75
Rot. Bonds1

About N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine

N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine (PubChem CID 144620136) has the molecular formula C7H5ClN2OS and a molecular weight of 200.65 g/mol. Its IUPAC name is N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine.

Molecular Properties

Compound NameN-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine
PubChem CID144620136
Molecular FormulaC7H5ClN2OS
Molecular Weight200.65 g/mol
Exact Mass199.98
IUPAC NameN-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine
SMILESONc1cnc2ccsc2c1Cl
InChIInChI=1S/C7H5ClN2OS/c8-6-5(10-11)3-9-4-1-2-12-7(4)6/h1-3,10-11H
InChIKeyRWUBBRSRZBHQFA-UHFFFAOYSA-N
XLogP2.75
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.65
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine?
The IUPAC name of N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine (CID 144620136) is N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine.
What is the SMILES notation for N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine?
The canonical SMILES for N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine is ONc1cnc2ccsc2c1Cl.
What is the InChIKey of N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine?
The InChIKey is RWUBBRSRZBHQFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2OS/c8-6-5(10-11)3-9-4-1-2-12-7(4)6/h1-3,10-11H.
What are the key properties of N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine?
N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine has a molecular weight of 200.65 g/mol, XLogP of 2.75, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-chlorothieno[3,2-b]pyridin-6-yl)hydroxylamine is sourced from PubChem (CID 144620136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).