1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine

C15H17NS — CID 2357426

IUPAC1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine
SMILESCc1ccc(/C=N/c2ccc(C(C)C)cc2)s1
InChIInChI=1S/C15H17NS/c1-11(2)13-5-7-14(8-6-13)16-10-15-9-4-12(3)17-15/h4-11H,1-3H3/b16-10+
InChIKeySELOKBKADVBLEX-MHWRWJLKSA-N
MW243.38 g/mol
LogP4.93
Rot. Bonds3

About 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine

1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine (PubChem CID 2357426) has the molecular formula C15H17NS and a molecular weight of 243.38 g/mol. Its IUPAC name is 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine.

Molecular Properties

Compound Name1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine
PubChem CID2357426
Molecular FormulaC15H17NS
Molecular Weight243.38 g/mol
Exact Mass243.11
IUPAC Name1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine
SMILESCc1ccc(/C=N/c2ccc(C(C)C)cc2)s1
InChIInChI=1S/C15H17NS/c1-11(2)13-5-7-14(8-6-13)16-10-15-9-4-12(3)17-15/h4-11H,1-3H3/b16-10+
InChIKeySELOKBKADVBLEX-MHWRWJLKSA-N
XLogP4.93
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-chlorothiophen-2-yl)-N-(4-methylphenyl)methanimine
CID 86221310
N-(4,6-dimethylpyrimidin-2-yl)-4-[(5-methylthiophen-2-yl)methylideneamino]benzenesulfonamide
CID 4266689
propyl 4-[(5-methylthiophen-2-yl)methylideneamino]benzoate
CID 3979255
N-[(Z)-(5-methylthiophen-2-yl)methylideneamino]-2-(4-propan-2-ylphenoxy)acetamide
CID 5420729
1-(5-methyl-1-phenylpyrrol-3-yl)-N-(4-propan-2-ylphenyl)methanimine
CID 50857725
1-(5-methylthiophen-2-yl)-N-[3-(trifluoromethyl)phenyl]methanimine
CID 964575
1-[4-[(4-propan-2-ylphenyl)methylideneamino]phenyl]ethanone
CID 4017717
1-butyl-3-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]sulfonylurea
CID 4988131
4-[(4-propan-2-ylphenyl)methylideneamino]benzamide
CID 1240043
dichloroiron;N-(4-trimethylsilylphenyl)-1-[5-[(4-trimethylsilylphenyl)iminomethyl]thiophen-2-yl]methanimine
CID 20701741
1-(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)-N-(4-propan-2-ylphenyl)methanimine
CID 21209348
N-(aminomethylidene)-N'-(4-propan-2-ylphenyl)methanimidamide;ethane
CID 143993393

Frequently Asked Questions

What is the IUPAC name of 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine?
The IUPAC name of 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine (CID 2357426) is 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine.
What is the SMILES notation for 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine?
The canonical SMILES for 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine is Cc1ccc(/C=N/c2ccc(C(C)C)cc2)s1.
What is the InChIKey of 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine?
The InChIKey is SELOKBKADVBLEX-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H17NS/c1-11(2)13-5-7-14(8-6-13)16-10-15-9-4-12(3)17-15/h4-11H,1-3H3/b16-10+.
What are the key properties of 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine?
1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine has a molecular weight of 243.38 g/mol, XLogP of 4.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylthiophen-2-yl)-N-(4-propan-2-ylphenyl)methanimine is sourced from PubChem (CID 2357426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).