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

C14H18N2O2 — CID 65181244

IUPACN-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
SMILESCCNC(C)c1ncc(-c2cccc(OC)c2)o1
InChIInChI=1S/C14H18N2O2/c1-4-15-10(2)14-16-9-13(18-14)11-6-5-7-12(8-11)17-3/h5-10,15H,4H2,1-3H3
InChIKeyDNRFRBYANFJDDN-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.02
Rot. Bonds5

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

N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine (PubChem CID 65181244) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
PubChem CID65181244
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
SMILESCCNC(C)c1ncc(-c2cccc(OC)c2)o1
InChIInChI=1S/C14H18N2O2/c1-4-15-10(2)14-16-9-13(18-14)11-6-5-7-12(8-11)17-3/h5-10,15H,4H2,1-3H3
InChIKeyDNRFRBYANFJDDN-UHFFFAOYSA-N
XLogP3.02
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-[5-(3-propan-2-yloxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181800
N-ethyl-1-[5-(3-iodophenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181501
N-[1-[5-(3-propoxyphenyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
CID 65183384
1-[5-(2,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-ethylethanamine
CID 65181194
N-ethyl-1-[5-(4-methoxy-3-nitrophenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181398
N-[[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]methyl]propan-2-amine
CID 65184141
5-(3-methoxyphenyl)-2-methyl-1,3-oxazole
CID 67394978
N-ethyl-1-[5-(4-methyl-3-nitrophenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181699
N-ethyl-1-[5-(3-methyl-4-nitrophenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181397
1-[5-(5-bromofuran-2-yl)-1,3-oxazol-2-yl]-N-ethylethanamine
CID 65181498
5-[1-(ethylamino)ethyl]-N-(3-methoxyphenyl)-N-methyl-1,3,4-oxadiazol-2-amine
CID 106970478
N-ethyl-1-[5-(2-iodophenyl)-1,3-oxazol-2-yl]ethanamine
CID 65181348

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine?
The IUPAC name of N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine (CID 65181244) is N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine is CCNC(C)c1ncc(-c2cccc(OC)c2)o1.
What is the InChIKey of N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine?
The InChIKey is DNRFRBYANFJDDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-4-15-10(2)14-16-9-13(18-14)11-6-5-7-12(8-11)17-3/h5-10,15H,4H2,1-3H3.
What are the key properties of N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine?
N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine has a molecular weight of 246.31 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine is sourced from PubChem (CID 65181244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).