N'-phenylthiophene-2-carboximidamide

C11H10N2S — CID 10219864

IUPACN'-phenylthiophene-2-carboximidamide
SMILESN/C(=N\c1ccccc1)c1cccs1
InChIInChI=1S/C11H10N2S/c12-11(10-7-4-8-14-10)13-9-5-2-1-3-6-9/h1-8H,(H2,12,13)
InChIKeyRCORNHOUCUDCAC-UHFFFAOYSA-N
MW202.28 g/mol
LogP2.79
Rot. Bonds2

About N'-phenylthiophene-2-carboximidamide

N'-phenylthiophene-2-carboximidamide (PubChem CID 10219864) has the molecular formula C11H10N2S and a molecular weight of 202.28 g/mol. Its IUPAC name is N'-phenylthiophene-2-carboximidamide.

Molecular Properties

Compound NameN'-phenylthiophene-2-carboximidamide
PubChem CID10219864
Molecular FormulaC11H10N2S
Molecular Weight202.28 g/mol
Exact Mass202.06
IUPAC NameN'-phenylthiophene-2-carboximidamide
SMILESN/C(=N\c1ccccc1)c1cccs1
InChIInChI=1S/C11H10N2S/c12-11(10-7-4-8-14-10)13-9-5-2-1-3-6-9/h1-8H,(H2,12,13)
InChIKeyRCORNHOUCUDCAC-UHFFFAOYSA-N
XLogP2.79
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 52.79
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'}

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Frequently Asked Questions

What is the IUPAC name of N'-phenylthiophene-2-carboximidamide?
The IUPAC name of N'-phenylthiophene-2-carboximidamide (CID 10219864) is N'-phenylthiophene-2-carboximidamide.
What is the SMILES notation for N'-phenylthiophene-2-carboximidamide?
The canonical SMILES for N'-phenylthiophene-2-carboximidamide is N/C(=N\c1ccccc1)c1cccs1.
What is the InChIKey of N'-phenylthiophene-2-carboximidamide?
The InChIKey is RCORNHOUCUDCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2S/c12-11(10-7-4-8-14-10)13-9-5-2-1-3-6-9/h1-8H,(H2,12,13).
What are the key properties of N'-phenylthiophene-2-carboximidamide?
N'-phenylthiophene-2-carboximidamide has a molecular weight of 202.28 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-phenylthiophene-2-carboximidamide is sourced from PubChem (CID 10219864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).