2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine

C17H17ClN2O3 — CID 112798638

IUPAC2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine
SMILESCN(CCOc1cccc(Cl)c1)Cc1cc(-c2ccco2)on1
InChIInChI=1S/C17H17ClN2O3/c1-20(7-9-21-15-5-2-4-13(18)10-15)12-14-11-17(23-19-14)16-6-3-8-22-16/h2-6,8,10-11H,7,9,12H2,1H3
InChIKeyUJKAZAOFLZSQSN-UHFFFAOYSA-N
MW332.79 g/mol
LogP4.10
Rot. Bonds7

About 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine

2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine (PubChem CID 112798638) has the molecular formula C17H17ClN2O3 and a molecular weight of 332.79 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine
PubChem CID112798638
Molecular FormulaC17H17ClN2O3
Molecular Weight332.79 g/mol
Exact Mass332.09
IUPAC Name2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine
SMILESCN(CCOc1cccc(Cl)c1)Cc1cc(-c2ccco2)on1
InChIInChI=1S/C17H17ClN2O3/c1-20(7-9-21-15-5-2-4-13(18)10-15)12-14-11-17(23-19-14)16-6-3-8-22-16/h2-6,8,10-11H,7,9,12H2,1H3
InChIKeyUJKAZAOFLZSQSN-UHFFFAOYSA-N
XLogP4.10
TPSA51.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.79
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine 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

1-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl-methylamino]-3-methoxypropan-2-ol
CID 62015350
2-(3-chlorophenoxy)-N-[(6-chloro-3-pyridinyl)methyl]-N-methylethanamine
CID 55537534
[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-(3-bromophenoxy)propanoate
CID 8887141
2-(3-chlorophenoxy)-N-methyl-N-[(2-propan-2-ylpyrimidin-5-yl)methyl]ethanamine
CID 131891193
2-[2-(3-chlorophenoxy)ethyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 17448221
3-(3-chlorophenoxy)-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-N-methylpropan-1-amine
CID 52679753
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylazetidin-3-amine
CID 66186647
N-[2-(3-chlorophenoxy)ethyl]-N-(furan-2-ylmethyl)-4-methoxybenzenesulfonamide
CID 18285388
N'-ethyl-N'-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]ethane-1,2-diamine
CID 114231162
3-[2-[(3-chlorophenyl)methyl-methylamino]ethoxy]aniline
CID 61413705
2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl-methylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 8551086
N-[(4-fluorophenyl)methyl]-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-3-methoxybenzamide
CID 51070823

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine?
The IUPAC name of 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine (CID 112798638) is 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine?
The canonical SMILES for 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine is CN(CCOc1cccc(Cl)c1)Cc1cc(-c2ccco2)on1.
What is the InChIKey of 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine?
The InChIKey is UJKAZAOFLZSQSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O3/c1-20(7-9-21-15-5-2-4-13(18)10-15)12-14-11-17(23-19-14)16-6-3-8-22-16/h2-6,8,10-11H,7,9,12H2,1H3.
What are the key properties of 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine?
2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine has a molecular weight of 332.79 g/mol, XLogP of 4.10, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylethanamine is sourced from PubChem (CID 112798638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).