4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol

C10H12N2OS — CID 16762657

IUPAC4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol
SMILESCC1CN=C(Nc2ccc(O)cc2)S1
InChIInChI=1S/C10H12N2OS/c1-7-6-11-10(14-7)12-8-2-4-9(13)5-3-8/h2-5,7,13H,6H2,1H3,(H,11,12)
InChIKeyQDXRVULQUCTVRI-UHFFFAOYSA-N
MW208.29 g/mol
LogP2.30
Rot. Bonds1

About 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol

4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol (PubChem CID 16762657) has the molecular formula C10H12N2OS and a molecular weight of 208.29 g/mol. Its IUPAC name is 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol.

Molecular Properties

Compound Name4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol
PubChem CID16762657
Molecular FormulaC10H12N2OS
Molecular Weight208.29 g/mol
Exact Mass208.07
IUPAC Name4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol
SMILESCC1CN=C(Nc2ccc(O)cc2)S1
InChIInChI=1S/C10H12N2OS/c1-7-6-11-10(14-7)12-8-2-4-9(13)5-3-8/h2-5,7,13H,6H2,1H3,(H,11,12)
InChIKeyQDXRVULQUCTVRI-UHFFFAOYSA-N
XLogP2.30
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol?
The IUPAC name of 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol (CID 16762657) is 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol.
What is the SMILES notation for 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol?
The canonical SMILES for 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol is CC1CN=C(Nc2ccc(O)cc2)S1.
What is the InChIKey of 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol?
The InChIKey is QDXRVULQUCTVRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS/c1-7-6-11-10(14-7)12-8-2-4-9(13)5-3-8/h2-5,7,13H,6H2,1H3,(H,11,12).
What are the key properties of 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol?
4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol has a molecular weight of 208.29 g/mol, XLogP of 2.30, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenol is sourced from PubChem (CID 16762657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).