3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide

C8H12N4OS — CID 63590449

IUPAC3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide
SMILESNNC(=O)CCSc1ccc(N)nc1
InChIInChI=1S/C8H12N4OS/c9-7-2-1-6(5-11-7)14-4-3-8(13)12-10/h1-2,5H,3-4,10H2,(H2,9,11)(H,12,13)
InChIKeyPSDKCMMMNXLCHR-UHFFFAOYSA-N
MW212.28 g/mol
LogP0.14
Rot. Bonds4

About 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide

3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide (PubChem CID 63590449) has the molecular formula C8H12N4OS and a molecular weight of 212.28 g/mol. Its IUPAC name is 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide.

Molecular Properties

Compound Name3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide
PubChem CID63590449
Molecular FormulaC8H12N4OS
Molecular Weight212.28 g/mol
Exact Mass212.07
IUPAC Name3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide
SMILESNNC(=O)CCSc1ccc(N)nc1
InChIInChI=1S/C8H12N4OS/c9-7-2-1-6(5-11-7)14-4-3-8(13)12-10/h1-2,5H,3-4,10H2,(H2,9,11)(H,12,13)
InChIKeyPSDKCMMMNXLCHR-UHFFFAOYSA-N
XLogP0.14
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.28
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-[(6-amino-3-pyridinyl)sulfanyl]-N-(methylcarbamoyl)propanamide
CID 43301810
3-(4-aminophenyl)sulfanylpropanehydrazide
CID 63580911
2-[4-[(6-amino-3-pyridinyl)sulfanylmethyl]phenyl]acetohydrazide
CID 105352452
4-[(6-amino-3-pyridinyl)sulfanyl]-N-methylbutanamide
CID 63891001
4-[(6-amino-3-pyridinyl)sulfanylmethyl]benzohydrazide
CID 63590631
2-[(6-amino-3-pyridinyl)sulfanyl]acetamide
CID 43302194
N-(6-amino-3-pyridinyl)-3-(3,4-dimethylphenyl)sulfanylpropanamide;hydrochloride
CID 119516033
5-[(6-amino-3-pyridinyl)sulfanylmethyl]oxolane-2-carbohydrazide
CID 63589022
5-[3-(methylamino)propylsulfanyl]pyridin-2-amine
CID 106318328
2-[(6-amino-3-pyridinyl)sulfanyl]-N-(tert-butylcarbamoyl)acetamide
CID 43302063
2-[(6-amino-3-pyridinyl)sulfanyl]-N-(propan-2-ylcarbamoyl)acetamide
CID 43302053
5-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfanyl]pyridin-2-amine
CID 104563701

Frequently Asked Questions

What is the IUPAC name of 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide?
The IUPAC name of 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide (CID 63590449) is 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide.
What is the SMILES notation for 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide?
The canonical SMILES for 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide is NNC(=O)CCSc1ccc(N)nc1.
What is the InChIKey of 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide?
The InChIKey is PSDKCMMMNXLCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4OS/c9-7-2-1-6(5-11-7)14-4-3-8(13)12-10/h1-2,5H,3-4,10H2,(H2,9,11)(H,12,13).
What are the key properties of 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide?
3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide has a molecular weight of 212.28 g/mol, XLogP of 0.14, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-amino-3-pyridinyl)sulfanyl]propanehydrazide is sourced from PubChem (CID 63590449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).