2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol

C11H12N2O2 — CID 136765417

IUPAC2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol
SMILESCc1noc(-c2ccccc2O)c1CN
InChIInChI=1S/C11H12N2O2/c1-7-9(6-12)11(15-13-7)8-4-2-3-5-10(8)14/h2-5,14H,6,12H2,1H3
InChIKeyFPPDQBPQXQHVSR-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.81
Rot. Bonds2

About 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol

2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol (PubChem CID 136765417) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol.

Molecular Properties

Compound Name2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol
PubChem CID136765417
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol
SMILESCc1noc(-c2ccccc2O)c1CN
InChIInChI=1S/C11H12N2O2/c1-7-9(6-12)11(15-13-7)8-4-2-3-5-10(8)14/h2-5,14H,6,12H2,1H3
InChIKeyFPPDQBPQXQHVSR-UHFFFAOYSA-N
XLogP1.81
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-amino-3-methyl-1,2-oxazol-5-yl)phenol
CID 135818847
[5-(4-tert-butyl-2-methylphenyl)-3-methyl-1,2-oxazol-4-yl]methanamine
CID 82483679
2-(3-methyl-4-nitro-1,2-oxazol-5-yl)phenol
CID 135818846
[5-(4-methoxy-2,5-dimethylphenyl)-3-methyl-1,2-oxazol-4-yl]methanamine
CID 82479432
[3-methyl-5-(4-methylsulfanylphenyl)-1,2-oxazol-4-yl]methanamine
CID 82475978
3-[5-(2-methoxyphenyl)-3-methyl-1,2-oxazol-4-yl]propanoic acid
CID 82302130
[5-(5-bromo-2-pyridinyl)-3-methyl-1,2-oxazol-4-yl]methanamine
CID 142610790
4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide
CID 123973953
4-benzyl-3-methyl-5-phenyl-1,2-oxazole
CID 14978502
[3-hydroxy-4-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenyl]oxidanium
CID 155722733
4-(aminomethyl)-3-methyl-1,2-oxazol-5-amine
CID 82502400
2-[5-(2-aminoethyl)-4,6-dimethylpyrimidin-2-yl]phenol
CID 137013043

Frequently Asked Questions

What is the IUPAC name of 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol?
The IUPAC name of 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol (CID 136765417) is 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol.
What is the SMILES notation for 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol?
The canonical SMILES for 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol is Cc1noc(-c2ccccc2O)c1CN.
What is the InChIKey of 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol?
The InChIKey is FPPDQBPQXQHVSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-7-9(6-12)11(15-13-7)8-4-2-3-5-10(8)14/h2-5,14H,6,12H2,1H3.
What are the key properties of 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol?
2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol has a molecular weight of 204.23 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(aminomethyl)-3-methyl-1,2-oxazol-5-yl]phenol is sourced from PubChem (CID 136765417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).