(2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine

C8H9NS — CID 139297349

IUPAC(2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine
SMILESC=c1scc/c1=C/C=N/C
InChIInChI=1S/C8H9NS/c1-7-8(3-5-9-2)4-6-10-7/h3-6H,1H2,2H3/b8-3-,9-5+
InChIKeyLXXQSEXZPNDXPF-ZNZATSSGSA-N
MW151.23 g/mol
LogP0.64
Rot. Bonds1

About (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine

(2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine (PubChem CID 139297349) has the molecular formula C8H9NS and a molecular weight of 151.23 g/mol. Its IUPAC name is (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine.

Molecular Properties

Compound Name(2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine
PubChem CID139297349
Molecular FormulaC8H9NS
Molecular Weight151.23 g/mol
Exact Mass151.05
IUPAC Name(2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine
SMILESC=c1scc/c1=C/C=N/C
InChIInChI=1S/C8H9NS/c1-7-8(3-5-9-2)4-6-10-7/h3-6H,1H2,2H3/b8-3-,9-5+
InChIKeyLXXQSEXZPNDXPF-ZNZATSSGSA-N
XLogP0.64
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.23
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5,5-Dimethylthieno[2,3-d]azepine
CID 70311060
(2E)-2-[(3Z)-3-(2-methylpropylidene)thiophen-2-ylidene]ethanimine
CID 87310153
(2E)-4-ethenylsulfanyl-3-methylpenta-2,4-dien-1-imine
CID 91550984
2-(2-but-2-enylidenethiophen-3-ylidene)-N-methylethanimine
CID 123368043
3-ethylidene-N-methylthiophen-2-imine
CID 123936114
6aH-thieno[2,3-b]pyrrole
CID 123991282
(3aZ,7Z,9E)-thieno[3,2-c]azocine
CID 139776980
N-[(1Z,3E)-3-methyl-2-methylsulfanylpenta-1,3-dienyl]ethanimine;prop-1-ene
CID 142809559
ethane;3-[(Z)-1-ethenylsulfanylprop-1-enyl]-2H-pyrrole
CID 143157875
ethane;3-[(Z)-1-ethylsulfanylprop-1-enyl]-2H-pyrrole
CID 143157915
(2Z,4E)-N,4-dimethyl-5-methylsulfanylpenta-2,4-dien-1-imine
CID 143830040
6-[(1Z)-2-methylbuta-1,3-dienyl]-2H-1,4-thiazine
CID 143838546

Frequently Asked Questions

What is the IUPAC name of (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine?
The IUPAC name of (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine (CID 139297349) is (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine.
What is the SMILES notation for (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine?
The canonical SMILES for (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine is C=c1scc/c1=C/C=N/C.
What is the InChIKey of (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine?
The InChIKey is LXXQSEXZPNDXPF-ZNZATSSGSA-N. The full InChI is InChI=1S/C8H9NS/c1-7-8(3-5-9-2)4-6-10-7/h3-6H,1H2,2H3/b8-3-,9-5+.
What are the key properties of (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine?
(2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine has a molecular weight of 151.23 g/mol, XLogP of 0.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-methyl-2-(2-methylidenethiophen-3-ylidene)ethanimine is sourced from PubChem (CID 139297349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).