5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine

C10H10N2S — CID 2783945

IUPAC5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine
SMILESC=C1CN=C(Nc2ccccc2)S1
InChIInChI=1S/C10H10N2S/c1-8-7-11-10(13-8)12-9-5-3-2-4-6-9/h2-6H,1,7H2,(H,11,12)
InChIKeyNUNMXJCJFUZAKF-UHFFFAOYSA-N
MW190.27 g/mol
LogP2.71
Rot. Bonds1

About 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine

5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine (PubChem CID 2783945) has the molecular formula C10H10N2S and a molecular weight of 190.27 g/mol. Its IUPAC name is 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine
PubChem CID2783945
Molecular FormulaC10H10N2S
Molecular Weight190.27 g/mol
Exact Mass190.06
IUPAC Name5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine
SMILESC=C1CN=C(Nc2ccccc2)S1
InChIInChI=1S/C10H10N2S/c1-8-7-11-10(13-8)12-9-5-3-2-4-6-9/h2-6H,1,7H2,(H,11,12)
InChIKeyNUNMXJCJFUZAKF-UHFFFAOYSA-N
XLogP2.71
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine?
The IUPAC name of 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine (CID 2783945) is 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine?
The canonical SMILES for 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine is C=C1CN=C(Nc2ccccc2)S1.
What is the InChIKey of 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine?
The InChIKey is NUNMXJCJFUZAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2S/c1-8-7-11-10(13-8)12-9-5-3-2-4-6-9/h2-6H,1,7H2,(H,11,12).
What are the key properties of 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine?
5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine has a molecular weight of 190.27 g/mol, XLogP of 2.71, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-N-phenyl-4H-1,3-thiazol-2-amine is sourced from PubChem (CID 2783945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).