N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine

C5H7N3S — CID 142391717

IUPACN-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine
SMILESC/N=C/c1nsc(C)n1
InChIInChI=1S/C5H7N3S/c1-4-7-5(3-6-2)8-9-4/h3H,1-2H3/b6-3+
InChIKeyPSJJLXTZRDOGRT-ZZXKWVIFSA-N
MW141.20 g/mol
LogP0.90
Rot. Bonds1

About N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine

N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine (PubChem CID 142391717) has the molecular formula C5H7N3S and a molecular weight of 141.20 g/mol. Its IUPAC name is N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine.

Molecular Properties

Compound NameN-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine
PubChem CID142391717
Molecular FormulaC5H7N3S
Molecular Weight141.20 g/mol
Exact Mass141.04
IUPAC NameN-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine
SMILESC/N=C/c1nsc(C)n1
InChIInChI=1S/C5H7N3S/c1-4-7-5(3-6-2)8-9-4/h3H,1-2H3/b6-3+
InChIKeyPSJJLXTZRDOGRT-ZZXKWVIFSA-N
XLogP0.90
TPSA38.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.20
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Dimethyl-1,2,4-thiadiazole
CID 13028086
sodium (E)-1-(3-methyl-1,2,4-thiadiazol-5-yl)-N-oxidomethanimine
CID 90674391
5-(Bromomethyl)-3-methyl-1,2,4-thiadiazole
CID 143843685
(NE)-N-[(3-methyl-1,2,4-thiadiazol-5-yl)methylidene]hydroxylamine
CID 135972456
3,5-Diethyl-1,2,4-thiadiazole
CID 67571441
3-Methyl-5-(nitrosomethylidene)-2,5-dihydro-1,2,4-thiadiazole
CID 136271575
(5-Methyl-1,2,4-thiadiazol-3-yl)methanethiol
CID 20699673
3-Methyl-1,2,4-thiadiazole-5-carbonitrile
CID 22099279
3-Ethyl-5-methyl-1,2,4-thiadiazole
CID 22947825
3,4,5-Trimethyl-1,2,4-thiadiazol-4-ium
CID 22959951
5-Ethyl-3-methyl-1,2,4-thiadiazole
CID 23528320
(3-Methyl-1,2,4-thiadiazol-5-yl)methanethiol
CID 57260787

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine?
The IUPAC name of N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine (CID 142391717) is N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine.
What is the SMILES notation for N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine?
The canonical SMILES for N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine is C/N=C/c1nsc(C)n1.
What is the InChIKey of N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine?
The InChIKey is PSJJLXTZRDOGRT-ZZXKWVIFSA-N. The full InChI is InChI=1S/C5H7N3S/c1-4-7-5(3-6-2)8-9-4/h3H,1-2H3/b6-3+.
What are the key properties of N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine?
N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine has a molecular weight of 141.20 g/mol, XLogP of 0.90, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methyl-1,2,4-thiadiazol-3-yl)methanimine is sourced from PubChem (CID 142391717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).