1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide

C10H18N6OS — CID 106321678

IUPAC1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(Cc2nnc(NN)s2)C1
InChIInChI=1S/C10H18N6OS/c1-10(8(17)12-2)3-4-16(6-10)5-7-14-15-9(13-11)18-7/h3-6,11H2,1-2H3,(H,12,17)(H,13,15)
InChIKeyGJIXFEUSZKULGJ-UHFFFAOYSA-N
MW270.36 g/mol
LogP-0.22
Rot. Bonds4

About 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide

1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide (PubChem CID 106321678) has the molecular formula C10H18N6OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
PubChem CID106321678
Molecular FormulaC10H18N6OS
Molecular Weight270.36 g/mol
Exact Mass270.13
IUPAC Name1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(Cc2nnc(NN)s2)C1
InChIInChI=1S/C10H18N6OS/c1-10(8(17)12-2)3-4-16(6-10)5-7-14-15-9(13-11)18-7/h3-6,11H2,1-2H3,(H,12,17)(H,13,15)
InChIKeyGJIXFEUSZKULGJ-UHFFFAOYSA-N
XLogP-0.22
TPSA96.17 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

1-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106321573
[5-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-1,3,4-thiadiazol-2-yl]hydrazine
CID 107395028
1-[[4-(hydrazinecarbonyl)phenyl]methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106322065
1-[(4-hydrazinyl-2-pyridinyl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106321690
1-[[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 114218082
1-[(4-amino-6-methylpyrimidin-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106321611
1-(3-hydrazinyl-3-oxopropyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106322049
1-[(5-chloropyrazin-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 114172807
1-[[3-(aminomethyl)-5-fluorophenyl]methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106317892
N,3-dimethyl-1-[2-(methylamino)ethyl]pyrrolidine-3-carboxamide
CID 106318104
1-(4-hydrazinyl-4-oxobutyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 114173352
[4-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114780204

Frequently Asked Questions

What is the IUPAC name of 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide (CID 106321678) is 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide is CNC(=O)C1(C)CCN(Cc2nnc(NN)s2)C1.
What is the InChIKey of 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide?
The InChIKey is GJIXFEUSZKULGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6OS/c1-10(8(17)12-2)3-4-16(6-10)5-7-14-15-9(13-11)18-7/h3-6,11H2,1-2H3,(H,12,17)(H,13,15).
What are the key properties of 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide?
1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide has a molecular weight of 270.36 g/mol, XLogP of -0.22, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106321678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).