N-methyl-N-phenylthiophen-3-amine

C11H11NS — CID 70651686

IUPACN-methyl-N-phenylthiophen-3-amine
SMILESCN(c1ccccc1)c1ccsc1
InChIInChI=1S/C11H11NS/c1-12(11-7-8-13-9-11)10-5-3-2-4-6-10/h2-9H,1H3
InChIKeyZELQTDZUJPPORD-UHFFFAOYSA-N
MW189.28 g/mol
LogP3.52
Rot. Bonds2

About N-methyl-N-phenylthiophen-3-amine

N-methyl-N-phenylthiophen-3-amine (PubChem CID 70651686) has the molecular formula C11H11NS and a molecular weight of 189.28 g/mol. Its IUPAC name is N-methyl-N-phenylthiophen-3-amine.

Molecular Properties

Compound NameN-methyl-N-phenylthiophen-3-amine
PubChem CID70651686
Molecular FormulaC11H11NS
Molecular Weight189.28 g/mol
Exact Mass189.06
IUPAC NameN-methyl-N-phenylthiophen-3-amine
SMILESCN(c1ccccc1)c1ccsc1
InChIInChI=1S/C11H11NS/c1-12(11-7-8-13-9-11)10-5-3-2-4-6-10/h2-9H,1H3
InChIKeyZELQTDZUJPPORD-UHFFFAOYSA-N
XLogP3.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.28
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenylthiophen-3-amine?
The IUPAC name of N-methyl-N-phenylthiophen-3-amine (CID 70651686) is N-methyl-N-phenylthiophen-3-amine.
What is the SMILES notation for N-methyl-N-phenylthiophen-3-amine?
The canonical SMILES for N-methyl-N-phenylthiophen-3-amine is CN(c1ccccc1)c1ccsc1.
What is the InChIKey of N-methyl-N-phenylthiophen-3-amine?
The InChIKey is ZELQTDZUJPPORD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NS/c1-12(11-7-8-13-9-11)10-5-3-2-4-6-10/h2-9H,1H3.
What are the key properties of N-methyl-N-phenylthiophen-3-amine?
N-methyl-N-phenylthiophen-3-amine has a molecular weight of 189.28 g/mol, XLogP of 3.52, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenylthiophen-3-amine is sourced from PubChem (CID 70651686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).