azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine

C13H18N2S — CID 174725909

IUPACazane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine
SMILESCc1ccc(N(C)c2ccc(C)s2)cc1.N
InChIInChI=1S/C13H15NS.H3N/c1-10-4-7-12(8-5-10)14(3)13-9-6-11(2)15-13;/h4-9H,1-3H3;1H3
InChIKeyQYVWYSSZVGLWES-UHFFFAOYSA-N
MW234.37 g/mol
LogP4.29
Rot. Bonds2

About azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine

azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine (PubChem CID 174725909) has the molecular formula C13H18N2S and a molecular weight of 234.37 g/mol. Its IUPAC name is azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine.

Molecular Properties

Compound Nameazane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine
PubChem CID174725909
Molecular FormulaC13H18N2S
Molecular Weight234.37 g/mol
Exact Mass234.12
IUPAC Nameazane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine
SMILESCc1ccc(N(C)c2ccc(C)s2)cc1.N
InChIInChI=1S/C13H15NS.H3N/c1-10-4-7-12(8-5-10)14(3)13-9-6-11(2)15-13;/h4-9H,1-3H3;1H3
InChIKeyQYVWYSSZVGLWES-UHFFFAOYSA-N
XLogP4.29
TPSA38.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.37
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine?
The IUPAC name of azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine (CID 174725909) is azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine.
What is the SMILES notation for azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine?
The canonical SMILES for azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine is Cc1ccc(N(C)c2ccc(C)s2)cc1.N.
What is the InChIKey of azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine?
The InChIKey is QYVWYSSZVGLWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NS.H3N/c1-10-4-7-12(8-5-10)14(3)13-9-6-11(2)15-13;/h4-9H,1-3H3;1H3.
What are the key properties of azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine?
azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine has a molecular weight of 234.37 g/mol, XLogP of 4.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;N,5-dimethyl-N-(4-methylphenyl)thiophen-2-amine is sourced from PubChem (CID 174725909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).