N-propylthiophen-3-amine

C7H11NS — CID 22669117

IUPACN-propylthiophen-3-amine
SMILESCCCNc1ccsc1
InChIInChI=1S/C7H11NS/c1-2-4-8-7-3-5-9-6-7/h3,5-6,8H,2,4H2,1H3
InChIKeyJKNMJPRHNWFYAF-UHFFFAOYSA-N
MW141.24 g/mol
LogP2.57
Rot. Bonds3

About N-propylthiophen-3-amine

N-propylthiophen-3-amine (PubChem CID 22669117) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is N-propylthiophen-3-amine.

Molecular Properties

Compound NameN-propylthiophen-3-amine
PubChem CID22669117
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC NameN-propylthiophen-3-amine
SMILESCCCNc1ccsc1
InChIInChI=1S/C7H11NS/c1-2-4-8-7-3-5-9-6-7/h3,5-6,8H,2,4H2,1H3
InChIKeyJKNMJPRHNWFYAF-UHFFFAOYSA-N
XLogP2.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propylthiophen-3-amine?
The IUPAC name of N-propylthiophen-3-amine (CID 22669117) is N-propylthiophen-3-amine.
What is the SMILES notation for N-propylthiophen-3-amine?
The canonical SMILES for N-propylthiophen-3-amine is CCCNc1ccsc1.
What is the InChIKey of N-propylthiophen-3-amine?
The InChIKey is JKNMJPRHNWFYAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NS/c1-2-4-8-7-3-5-9-6-7/h3,5-6,8H,2,4H2,1H3.
What are the key properties of N-propylthiophen-3-amine?
N-propylthiophen-3-amine has a molecular weight of 141.24 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propylthiophen-3-amine is sourced from PubChem (CID 22669117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).