N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine

C15H21N3O2 — CID 103175612

IUPACN-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine
SMILESCCNCc1cc(COc2ccc(C)nc2CC)on1
InChIInChI=1S/C15H21N3O2/c1-4-14-15(7-6-11(3)17-14)19-10-13-8-12(18-20-13)9-16-5-2/h6-8,16H,4-5,9-10H2,1-3H3
InChIKeyGNACYPAQJTYAGG-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.63
Rot. Bonds7

About N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine

N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine (PubChem CID 103175612) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine
PubChem CID103175612
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine
SMILESCCNCc1cc(COc2ccc(C)nc2CC)on1
InChIInChI=1S/C15H21N3O2/c1-4-14-15(7-6-11(3)17-14)19-10-13-8-12(18-20-13)9-16-5-2/h6-8,16H,4-5,9-10H2,1-3H3
InChIKeyGNACYPAQJTYAGG-UHFFFAOYSA-N
XLogP2.63
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine with MolForge

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Launch Full Analysis

Related Compounds

[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methanamine
CID 103175605
N-[[5-[(2,4-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62452940
N-[[5-[(4-ethyl-2-methoxyphenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 107668507
1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine
CID 103175544
[3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]-6-methyl-2-pyridinyl]methanamine
CID 79150560
N-[[5-[(4-fluorophenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62453644
N-[[5-[(2-methylpropan-2-yl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62455470
N-[[5-[(3-ethylphenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62450321
N-[[6-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methoxy]-2-pyridinyl]methyl]propan-2-amine
CID 79150848
N-[[5-[(3,5-difluorophenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62783622
N-[[5-[(3-ethoxyphenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62443165
N-[[3-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-6-methyl-2-pyridinyl]methyl]ethanamine
CID 79151442

Frequently Asked Questions

What is the IUPAC name of N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine?
The IUPAC name of N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine (CID 103175612) is N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine is CCNCc1cc(COc2ccc(C)nc2CC)on1.
What is the InChIKey of N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine?
The InChIKey is GNACYPAQJTYAGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-4-14-15(7-6-11(3)17-14)19-10-13-8-12(18-20-13)9-16-5-2/h6-8,16H,4-5,9-10H2,1-3H3.
What are the key properties of N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine?
N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine has a molecular weight of 275.35 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazol-3-yl]methyl]ethanamine is sourced from PubChem (CID 103175612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).