2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol

C10H10N2OS — CID 91621048

IUPAC2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol
SMILESNC1=N/C(=C/c2ccccc2O)CS1
InChIInChI=1S/C10H10N2OS/c11-10-12-8(6-14-10)5-7-3-1-2-4-9(7)13/h1-5,13H,6H2,(H2,11,12)/b8-5+
InChIKeyWNZGVZRQJGYFPL-VMPITWQZSA-N
MW206.27 g/mol
LogP1.79
Rot. Bonds1

About 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol

2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol (PubChem CID 91621048) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol.

Molecular Properties

Compound Name2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol
PubChem CID91621048
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC Name2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol
SMILESNC1=N/C(=C/c2ccccc2O)CS1
InChIInChI=1S/C10H10N2OS/c11-10-12-8(6-14-10)5-7-3-1-2-4-9(7)13/h1-5,13H,6H2,(H2,11,12)/b8-5+
InChIKeyWNZGVZRQJGYFPL-VMPITWQZSA-N
XLogP1.79
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-aminoindol-3-ylidene)methyl]phenol
CID 137201355
2-ethenylphenol
CID 161061609
2-(cyclohexa-2,4-dien-1-ylidenemethyl)phenol
CID 141109666
CID 162316519
CID 162316519
3-(2-hydroxyphenyl)prop-2-ene-1,1-diol
CID 57308836
2-amino-5-[(2-chloro-3-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
CID 2940813
benzene-1,2-diamine;bis(2-hydroxybenzaldehyde)
CID 87647711
benzene-1,2-diamine;2-hydroxybenzaldehyde
CID 22463498
copper;2-[(E)-hydrazinylidenemethyl]phenol;hydrate
CID 137286073
sodium;hydride;2-hydroxybenzaldehyde
CID 173406661
aniline;2-hydroxybenzaldehyde
CID 159847329
CID 158421076
CID 158421076

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol?
The IUPAC name of 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol (CID 91621048) is 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol.
What is the SMILES notation for 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol?
The canonical SMILES for 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol is NC1=N/C(=C/c2ccccc2O)CS1.
What is the InChIKey of 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol?
The InChIKey is WNZGVZRQJGYFPL-VMPITWQZSA-N. The full InChI is InChI=1S/C10H10N2OS/c11-10-12-8(6-14-10)5-7-3-1-2-4-9(7)13/h1-5,13H,6H2,(H2,11,12)/b8-5+.
What are the key properties of 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol?
2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol has a molecular weight of 206.27 g/mol, XLogP of 1.79, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-(2-amino-1,3-thiazol-4-ylidene)methyl]phenol is sourced from PubChem (CID 91621048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).