thiophen-3-amine

C4H5NS — CID 640543

IUPACthiophen-3-amine
SMILESNc1ccsc1
InChIInChI=1S/C4H5NS/c5-4-1-2-6-3-4/h1-3H,5H2
InChIKeyDKGYESBFCGKOJC-UHFFFAOYSA-N
MW99.16 g/mol
LogP1.33
Rot. Bonds

About thiophen-3-amine

thiophen-3-amine (PubChem CID 640543) has the molecular formula C4H5NS and a molecular weight of 99.16 g/mol. Its IUPAC name is thiophen-3-amine.

Molecular Properties

Compound Namethiophen-3-amine
PubChem CID640543
Molecular FormulaC4H5NS
Molecular Weight99.16 g/mol
Exact Mass99.01
IUPAC Namethiophen-3-amine
SMILESNc1ccsc1
InChIInChI=1S/C4H5NS/c5-4-1-2-6-3-4/h1-3H,5H2
InChIKeyDKGYESBFCGKOJC-UHFFFAOYSA-N
XLogP1.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.16
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of thiophen-3-amine?
The IUPAC name of thiophen-3-amine (CID 640543) is thiophen-3-amine.
What is the SMILES notation for thiophen-3-amine?
The canonical SMILES for thiophen-3-amine is Nc1ccsc1.
What is the InChIKey of thiophen-3-amine?
The InChIKey is DKGYESBFCGKOJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NS/c5-4-1-2-6-3-4/h1-3H,5H2.
What are the key properties of thiophen-3-amine?
thiophen-3-amine has a molecular weight of 99.16 g/mol, XLogP of 1.33, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for thiophen-3-amine is sourced from PubChem (CID 640543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).