1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol

C14H18N2O4 — CID 81177818

IUPAC1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol
SMILESCOc1ccccc1OCC(O)CNCc1ccon1
InChIInChI=1S/C14H18N2O4/c1-18-13-4-2-3-5-14(13)19-10-12(17)9-15-8-11-6-7-20-16-11/h2-7,12,15,17H,8-10H2,1H3
InChIKeyPZXNFTWLPDFPHZ-UHFFFAOYSA-N
MW278.31 g/mol
LogP1.21
Rot. Bonds8

About 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol

1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol (PubChem CID 81177818) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol.

Molecular Properties

Compound Name1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol
PubChem CID81177818
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol
SMILESCOc1ccccc1OCC(O)CNCc1ccon1
InChIInChI=1S/C14H18N2O4/c1-18-13-4-2-3-5-14(13)19-10-12(17)9-15-8-11-6-7-20-16-11/h2-7,12,15,17H,8-10H2,1H3
InChIKeyPZXNFTWLPDFPHZ-UHFFFAOYSA-N
XLogP1.21
TPSA76.75 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol 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-[(2-methylpropan-2-yl)oxy]-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol
CID 81178583
1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol
CID 106372231
1-(2-methoxyphenoxy)-3-(2-methylsulfanylethylamino)propan-2-ol
CID 63965784
1-(2-methoxyphenoxy)-3-(2-methylprop-2-enylamino)propan-2-ol
CID 114616905
1-(1,2-oxazol-3-ylmethylamino)-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol
CID 81178345
4-[[2-hydroxy-3-(2-methoxyphenoxy)propyl]amino]-1-methoxybutan-2-ol
CID 106246755
2-[[2-hydroxy-3-(2-methoxyphenoxy)propyl]amino]-N-methylacetamide
CID 60901229
1-[(2-cyclopropyl-2-hydroxyethyl)amino]-3-(2-methoxyphenoxy)propan-2-ol
CID 63296623
1-(diethylamino)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol
CID 81176957
1-(2-methylphenoxy)-3-(pyridin-2-ylmethylamino)propan-2-ol
CID 60634071
3-(2-methoxyphenoxy)propane-1,2-diol
CID 3516
(2S)-1-(benzylamino)-3-(2-ethoxyphenoxy)propan-2-ol
CID 39424747

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol?
The IUPAC name of 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol (CID 81177818) is 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol.
What is the SMILES notation for 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol?
The canonical SMILES for 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol is COc1ccccc1OCC(O)CNCc1ccon1.
What is the InChIKey of 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol?
The InChIKey is PZXNFTWLPDFPHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-18-13-4-2-3-5-14(13)19-10-12(17)9-15-8-11-6-7-20-16-11/h2-7,12,15,17H,8-10H2,1H3.
What are the key properties of 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol?
1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol has a molecular weight of 278.31 g/mol, XLogP of 1.21, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol is sourced from PubChem (CID 81177818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).