N,5-dimethylthiophen-3-amine

C6H9NS — CID 57096336

IUPACN,5-dimethylthiophen-3-amine
SMILESCNc1csc(C)c1
InChIInChI=1S/C6H9NS/c1-5-3-6(7-2)4-8-5/h3-4,7H,1-2H3
InChIKeyOOPUOUDGOMMYFX-UHFFFAOYSA-N
MW127.21 g/mol
LogP2.10
Rot. Bonds1

About N,5-dimethylthiophen-3-amine

N,5-dimethylthiophen-3-amine (PubChem CID 57096336) has the molecular formula C6H9NS and a molecular weight of 127.21 g/mol. Its IUPAC name is N,5-dimethylthiophen-3-amine.

Molecular Properties

Compound NameN,5-dimethylthiophen-3-amine
PubChem CID57096336
Molecular FormulaC6H9NS
Molecular Weight127.21 g/mol
Exact Mass127.05
IUPAC NameN,5-dimethylthiophen-3-amine
SMILESCNc1csc(C)c1
InChIInChI=1S/C6H9NS/c1-5-3-6(7-2)4-8-5/h3-4,7H,1-2H3
InChIKeyOOPUOUDGOMMYFX-UHFFFAOYSA-N
XLogP2.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.21
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethylthiophen-3-amine?
The IUPAC name of N,5-dimethylthiophen-3-amine (CID 57096336) is N,5-dimethylthiophen-3-amine.
What is the SMILES notation for N,5-dimethylthiophen-3-amine?
The canonical SMILES for N,5-dimethylthiophen-3-amine is CNc1csc(C)c1.
What is the InChIKey of N,5-dimethylthiophen-3-amine?
The InChIKey is OOPUOUDGOMMYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NS/c1-5-3-6(7-2)4-8-5/h3-4,7H,1-2H3.
What are the key properties of N,5-dimethylthiophen-3-amine?
N,5-dimethylthiophen-3-amine has a molecular weight of 127.21 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethylthiophen-3-amine is sourced from PubChem (CID 57096336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).