N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine

C9H8N2OS — CID 130883012

IUPACN-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine
SMILESCC(=NO)c1csc2ncccc12
InChIInChI=1S/C9H8N2OS/c1-6(11-12)8-5-13-9-7(8)3-2-4-10-9/h2-5,12H,1H3
InChIKeyGEVLRZWMNBPZLQ-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.49
Rot. Bonds1

About N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine

N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine (PubChem CID 130883012) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine.

Molecular Properties

Compound NameN-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine
PubChem CID130883012
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC NameN-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine
SMILESCC(=NO)c1csc2ncccc12
InChIInChI=1S/C9H8N2OS/c1-6(11-12)8-5-13-9-7(8)3-2-4-10-9/h2-5,12H,1H3
InChIKeyGEVLRZWMNBPZLQ-UHFFFAOYSA-N
XLogP2.49
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-oxothiopyrano[2,3-b]pyridine-3-carboxylic acid
CID 74892802
3-cyclopropylthieno[2,3-b]pyridine
CID 119087285
2-thieno[2,3-b]pyridin-3-ylacetic acid
CID 82402092
4-thieno[2,3-b]pyridin-3-ylphenol
CID 139624317
3-(4,5-dimethyl-1,2,4-triazol-3-yl)thieno[2,3-b]pyridine
CID 59796423
3-(2,5-dimethyl-1,3-dihydro-1,2,4-triazol-3-yl)thieno[2,3-b]pyridine
CID 142265859
3-(fluoromethoxy)thieno[2,3-b]pyridine
CID 119087038
N-[1-(3-methyl-1,2-benzothiazol-7-yl)ethylidene]hydroxylamine
CID 72746402
1-methyl-5-thieno[2,3-b]pyridin-3-ylpiperidin-3-amine
CID 82383679
1-methyl-6-thieno[2,3-b]pyridin-3-ylpiperidin-3-amine
CID 82383690
N-[1-(3-fluoro-4-pyridinyl)ethylidene]hydroxylamine;hydrochloride
CID 137005773
2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenol
CID 135410018

Frequently Asked Questions

What is the IUPAC name of N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine?
The IUPAC name of N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine (CID 130883012) is N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine.
What is the SMILES notation for N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine?
The canonical SMILES for N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine is CC(=NO)c1csc2ncccc12.
What is the InChIKey of N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine?
The InChIKey is GEVLRZWMNBPZLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c1-6(11-12)8-5-13-9-7(8)3-2-4-10-9/h2-5,12H,1H3.
What are the key properties of N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine?
N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine has a molecular weight of 192.24 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thieno[2,3-b]pyridin-3-ylethylidene)hydroxylamine is sourced from PubChem (CID 130883012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).