N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide

C10H19N3O5S2 — CID 18801502

IUPACN-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide
SMILESO=C(CNNC1CCS(=O)(=O)C1)NC1CCS(=O)(=O)C1
InChIInChI=1S/C10H19N3O5S2/c14-10(12-8-1-3-19(15,16)6-8)5-11-13-9-2-4-20(17,18)7-9/h8-9,11,13H,1-7H2,(H,12,14)
InChIKeyRLVWSNANNNULTM-UHFFFAOYSA-N
MW325.41 g/mol
LogP-2.43
Rot. Bonds5

About N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide

N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide (PubChem CID 18801502) has the molecular formula C10H19N3O5S2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide.

Molecular Properties

Compound NameN-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide
PubChem CID18801502
Molecular FormulaC10H19N3O5S2
Molecular Weight325.41 g/mol
Exact Mass325.08
IUPAC NameN-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide
SMILESO=C(CNNC1CCS(=O)(=O)C1)NC1CCS(=O)(=O)C1
InChIInChI=1S/C10H19N3O5S2/c14-10(12-8-1-3-19(15,16)6-8)5-11-13-9-2-4-20(17,18)7-9/h8-9,11,13H,1-7H2,(H,12,14)
InChIKeyRLVWSNANNNULTM-UHFFFAOYSA-N
XLogP-2.43
TPSA121.44 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 5-2.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

3-[[2-[(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl]amino]propanoic acid
CID 43466548
6-[(1,1-dioxothiolan-3-yl)amino]-6-oxohexanoic acid
CID 43529555
N-[(3S)-1,1-dioxothiolan-3-yl]-2-iodoacetamide
CID 9196310
2-(1,1-dioxothian-4-yl)-N-(1,1-dioxothiolan-3-yl)acetamide
CID 110852811
N-(1,1-dioxothiolan-3-yl)butanamide
CID 18573523
N-cyclohexyl-2-[(1,1-dioxothiolan-3-yl)amino]acetamide
CID 43179464
N-cycloheptyl-2-[(1,1-dioxothiolan-3-yl)amino]acetamide
CID 55024086
N-[(3S)-1,1-dioxothiolan-3-yl]-2-phenylacetamide
CID 40569648
2-[[2-[(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl]amino]pentanoic acid
CID 43631799
N,N'-bis[(3S)-1,1-dioxothiolan-3-yl]oxamide
CID 7102189
1,3-bis(1,1-dioxothiolan-3-yl)urea
CID 2831152
3-amino-N-(1,1-dioxothiolan-3-yl)propanamide;hydrochloride
CID 42943455

Frequently Asked Questions

What is the IUPAC name of N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide?
The IUPAC name of N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide (CID 18801502) is N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide.
What is the SMILES notation for N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide?
The canonical SMILES for N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide is O=C(CNNC1CCS(=O)(=O)C1)NC1CCS(=O)(=O)C1.
What is the InChIKey of N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide?
The InChIKey is RLVWSNANNNULTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O5S2/c14-10(12-8-1-3-19(15,16)6-8)5-11-13-9-2-4-20(17,18)7-9/h8-9,11,13H,1-7H2,(H,12,14).
What are the key properties of N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide?
N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide has a molecular weight of 325.41 g/mol, XLogP of -2.43, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1-dioxothiolan-3-yl)-2-[2-(1,1-dioxothiolan-3-yl)hydrazinyl]acetamide is sourced from PubChem (CID 18801502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).