N'-cyclopropylthiophene-3-carboximidamide

C8H10N2S — CID 62049208

IUPACN'-cyclopropylthiophene-3-carboximidamide
SMILESN/C(=N\C1CC1)c1ccsc1
InChIInChI=1S/C8H10N2S/c9-8(10-7-1-2-7)6-3-4-11-5-6/h3-5,7H,1-2H2,(H2,9,10)
InChIKeyGIIIGMLAUFAGCK-UHFFFAOYSA-N
MW166.25 g/mol
LogP1.62
Rot. Bonds2

About N'-cyclopropylthiophene-3-carboximidamide

N'-cyclopropylthiophene-3-carboximidamide (PubChem CID 62049208) has the molecular formula C8H10N2S and a molecular weight of 166.25 g/mol. Its IUPAC name is N'-cyclopropylthiophene-3-carboximidamide.

Molecular Properties

Compound NameN'-cyclopropylthiophene-3-carboximidamide
PubChem CID62049208
Molecular FormulaC8H10N2S
Molecular Weight166.25 g/mol
Exact Mass166.06
IUPAC NameN'-cyclopropylthiophene-3-carboximidamide
SMILESN/C(=N\C1CC1)c1ccsc1
InChIInChI=1S/C8H10N2S/c9-8(10-7-1-2-7)6-3-4-11-5-6/h3-5,7H,1-2H2,(H2,9,10)
InChIKeyGIIIGMLAUFAGCK-UHFFFAOYSA-N
XLogP1.62
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N'-cyclopropylthiophene-3-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropylthiophene-3-carboximidamide?
The IUPAC name of N'-cyclopropylthiophene-3-carboximidamide (CID 62049208) is N'-cyclopropylthiophene-3-carboximidamide.
What is the SMILES notation for N'-cyclopropylthiophene-3-carboximidamide?
The canonical SMILES for N'-cyclopropylthiophene-3-carboximidamide is N/C(=N\C1CC1)c1ccsc1.
What is the InChIKey of N'-cyclopropylthiophene-3-carboximidamide?
The InChIKey is GIIIGMLAUFAGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2S/c9-8(10-7-1-2-7)6-3-4-11-5-6/h3-5,7H,1-2H2,(H2,9,10).
What are the key properties of N'-cyclopropylthiophene-3-carboximidamide?
N'-cyclopropylthiophene-3-carboximidamide has a molecular weight of 166.25 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropylthiophene-3-carboximidamide is sourced from PubChem (CID 62049208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).