[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine

C12H14N2O2 — CID 65179378

IUPAC[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine
SMILESCCOc1ccc(-c2cnc(CN)o2)cc1
InChIInChI=1S/C12H14N2O2/c1-2-15-10-5-3-9(4-6-10)11-8-14-12(7-13)16-11/h3-6,8H,2,7,13H2,1H3
InChIKeyUBHCSLXZSGTLBA-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.20
Rot. Bonds4

About [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine

[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine (PubChem CID 65179378) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine
PubChem CID65179378
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine
SMILESCCOc1ccc(-c2cnc(CN)o2)cc1
InChIInChI=1S/C12H14N2O2/c1-2-15-10-5-3-9(4-6-10)11-8-14-12(7-13)16-11/h3-6,8H,2,7,13H2,1H3
InChIKeyUBHCSLXZSGTLBA-UHFFFAOYSA-N
XLogP2.20
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine 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

[5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazol-2-yl]methanamine
CID 82360062
[5-(3,4-diethoxyphenyl)-1,3-oxazol-2-yl]methanamine
CID 65179555
5-(4-ethoxyphenyl)-2-methyl-1,3-oxazole
CID 166610196
[5-(3-chloro-4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine
CID 82298313
3-[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]-N-propan-2-ylpropan-1-amine
CID 65187422
2-[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methoxyethyl)ethanamine
CID 65182714
[5-(4-hexylphenyl)-1,3-oxazol-2-yl]methanamine
CID 82360063
2-(chloromethyl)-5-(4-propoxyphenyl)-1,3-oxazole
CID 43144208
[5-(6-bromonaphthalen-2-yl)-1,3-oxazol-2-yl]methanamine
CID 113292812
[2-(4-ethoxyanilino)-2-oxoethyl] 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanoate
CID 16579877
[5-(4-methoxy-2-methylphenyl)-1,3-oxazol-2-yl]methanamine
CID 82360064
2-[5-(3-chloro-4-ethoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 95471843

Frequently Asked Questions

What is the IUPAC name of [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine (CID 65179378) is [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine is CCOc1ccc(-c2cnc(CN)o2)cc1.
What is the InChIKey of [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine?
The InChIKey is UBHCSLXZSGTLBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-2-15-10-5-3-9(4-6-10)11-8-14-12(7-13)16-11/h3-6,8H,2,7,13H2,1H3.
What are the key properties of [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine?
[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine has a molecular weight of 218.26 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 65179378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).