N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine

C15H20N2O2 — CID 60887616

IUPACN-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine
SMILESCCNC(C)c1cccc(OCc2cc(C)no2)c1
InChIInChI=1S/C15H20N2O2/c1-4-16-12(3)13-6-5-7-14(9-13)18-10-15-8-11(2)17-19-15/h5-9,12,16H,4,10H2,1-3H3
InChIKeyHJMNMGPWHRTIBE-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.23
Rot. Bonds6

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

N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine (PubChem CID 60887616) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine
PubChem CID60887616
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine
SMILESCCNC(C)c1cccc(OCc2cc(C)no2)c1
InChIInChI=1S/C15H20N2O2/c1-4-16-12(3)13-6-5-7-14(9-13)18-10-15-8-11(2)17-19-15/h5-9,12,16H,4,10H2,1-3H3
InChIKeyHJMNMGPWHRTIBE-UHFFFAOYSA-N
XLogP3.23
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole
CID 60681199
3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenol
CID 43143519
N-ethyl-1-[4-methoxy-2-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine
CID 82000944
N-ethyl-1-[3-(methoxymethoxy)phenyl]ethanamine
CID 65365407
(1R)-1-(3-butoxyphenyl)-N-ethylethanamine
CID 93007499
1-[3-[(3-chlorophenyl)methoxy]phenyl]-N-ethylethanamine
CID 60881758
N-[1-[3-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethyl]propan-1-amine
CID 60887619
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-1-phenylethanamine
CID 60713961
2-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]acetic acid
CID 61398198
1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine
CID 107716681
3-[3-[1-(ethylamino)ethyl]phenoxy]-N,N-dimethylpropanamide
CID 54879287
5-[(2,6-dimethylphenoxy)methyl]-3-methyl-1,2-oxazole
CID 78913723

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine?
The IUPAC name of N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine (CID 60887616) is N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine.
What is the SMILES notation for N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine?
The canonical SMILES for N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine is CCNC(C)c1cccc(OCc2cc(C)no2)c1.
What is the InChIKey of N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine?
The InChIKey is HJMNMGPWHRTIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-16-12(3)13-6-5-7-14(9-13)18-10-15-8-11(2)17-19-15/h5-9,12,16H,4,10H2,1-3H3.
What are the key properties of N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine?
N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine has a molecular weight of 260.34 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 60887616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).