N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine

C14H18N2O2 — CID 65182800

IUPACN-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
SMILESCCNCCc1ncc(-c2ccccc2OC)o1
InChIInChI=1S/C14H18N2O2/c1-3-15-9-8-14-16-10-13(18-14)11-6-4-5-7-12(11)17-2/h4-7,10,15H,3,8-9H2,1-2H3
InChIKeyUIZFFRSKSCPOAJ-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.50
Rot. Bonds6

About N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine

N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine (PubChem CID 65182800) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
PubChem CID65182800
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
SMILESCCNCCc1ncc(-c2ccccc2OC)o1
InChIInChI=1S/C14H18N2O2/c1-3-15-9-8-14-16-10-13(18-14)11-6-4-5-7-12(11)17-2/h4-7,10,15H,3,8-9H2,1-2H3
InChIKeyUIZFFRSKSCPOAJ-UHFFFAOYSA-N
XLogP2.50
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[5-(2-ethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylpropan-1-amine
CID 65187014
N-ethyl-2-[5-(2-iodophenyl)-1,3-oxazol-2-yl]ethanamine
CID 65183054
N-[2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine
CID 65182442
2-(3-chloropropyl)-5-(2-methoxyphenyl)-1,3-oxazole
CID 65180005
2-[5-(3-chloro-2-fluorophenyl)-1,3-oxazol-2-yl]-N-ethylethanamine
CID 81263080
7-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]heptanal
CID 89098544
N-ethyl-2-[5-(3-fluoro-4-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 65183247
N-[2-[5-(2-ethoxyphenyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine
CID 65182202
N-[2-[5-(2-bromophenyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
CID 65183219
2-[5-(2,6-dichlorophenyl)-1,3-oxazol-2-yl]-N-ethylethanamine
CID 65182949
2-[5-(2,5-dichlorophenyl)-1,3-oxazol-2-yl]-N-ethylethanamine
CID 65183095
3-[5-(4-chloro-2-methoxyphenyl)-1,3-oxazol-2-yl]-N-propylpropan-1-amine
CID 65187028

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine?
The IUPAC name of N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine (CID 65182800) is N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine.
What is the SMILES notation for N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine?
The canonical SMILES for N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine is CCNCCc1ncc(-c2ccccc2OC)o1.
What is the InChIKey of N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine?
The InChIKey is UIZFFRSKSCPOAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-3-15-9-8-14-16-10-13(18-14)11-6-4-5-7-12(11)17-2/h4-7,10,15H,3,8-9H2,1-2H3.
What are the key properties of N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine?
N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine has a molecular weight of 246.31 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[5-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine is sourced from PubChem (CID 65182800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).