[4-(2-azidoethoxy)-3-methoxyphenyl]methanol

C10H13N3O3 — CID 20769149

IUPAC[4-(2-azidoethoxy)-3-methoxyphenyl]methanol
SMILESCOc1cc(CO)ccc1OCCN=[N+]=[N-]
InChIInChI=1S/C10H13N3O3/c1-15-10-6-8(7-14)2-3-9(10)16-5-4-12-13-11/h2-3,6,14H,4-5,7H2,1H3
InChIKeyQWMLETNVEGDLKY-UHFFFAOYSA-N
MW223.23 g/mol
LogP1.88
Rot. Bonds6

About [4-(2-azidoethoxy)-3-methoxyphenyl]methanol

[4-(2-azidoethoxy)-3-methoxyphenyl]methanol (PubChem CID 20769149) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is [4-(2-azidoethoxy)-3-methoxyphenyl]methanol.

Molecular Properties

Compound Name[4-(2-azidoethoxy)-3-methoxyphenyl]methanol
PubChem CID20769149
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name[4-(2-azidoethoxy)-3-methoxyphenyl]methanol
SMILESCOc1cc(CO)ccc1OCCN=[N+]=[N-]
InChIInChI=1S/C10H13N3O3/c1-15-10-6-8(7-14)2-3-9(10)16-5-4-12-13-11/h2-3,6,14H,4-5,7H2,1H3
InChIKeyQWMLETNVEGDLKY-UHFFFAOYSA-N
XLogP1.88
TPSA87.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze [4-(2-azidoethoxy)-3-methoxyphenyl]methanol 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

[4-(3-azidopropoxy)-3-methoxyphenyl]methanol
CID 107744213
1-(2-azidoethoxy)-2-bromo-4-methoxybenzene
CID 104708216
[3-methoxy-4-(2-phenylethoxy)phenyl]methanol
CID 28562144
N'-hydroxy-3-[4-(hydroxymethyl)-2-methoxyphenoxy]propanimidamide
CID 107743240
5,12,19-tris(2-azidoethoxy)-6,13,20-trimethoxytetracyclo[15.4.0.03,8.010,15]henicosa-1(21),3,5,7,10,12,14,17,19-nonaene
CID 53254613
[3-(2-azidoethoxy)phenyl]methanol
CID 59552460
[4-(2-butoxyethoxy)-3-methoxyphenyl]methanol
CID 61035977
[4-(3-ethylsulfanylpropoxy)-3-methoxyphenyl]methanol
CID 115659185
N-[[4-(2-azidoethoxy)-3-methoxyphenyl]methyl]octadec-9-enamide
CID 54514212
3-azido-1-[5-(hydroxymethyl)-2-methoxyphenyl]propane-1,2-diol
CID 170826312
[(2R)-2-[[2-[4-(2-azidoethoxy)-3-methoxyphenyl]acetyl]amino]-1-phenylpropan-2-yl] 2,2-dimethylpropanoate
CID 91156304
(3-methoxy-4-phosphanyloxyphenyl)methanol
CID 89023367

Frequently Asked Questions

What is the IUPAC name of [4-(2-azidoethoxy)-3-methoxyphenyl]methanol?
The IUPAC name of [4-(2-azidoethoxy)-3-methoxyphenyl]methanol (CID 20769149) is [4-(2-azidoethoxy)-3-methoxyphenyl]methanol.
What is the SMILES notation for [4-(2-azidoethoxy)-3-methoxyphenyl]methanol?
The canonical SMILES for [4-(2-azidoethoxy)-3-methoxyphenyl]methanol is COc1cc(CO)ccc1OCCN=[N+]=[N-].
What is the InChIKey of [4-(2-azidoethoxy)-3-methoxyphenyl]methanol?
The InChIKey is QWMLETNVEGDLKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c1-15-10-6-8(7-14)2-3-9(10)16-5-4-12-13-11/h2-3,6,14H,4-5,7H2,1H3.
What are the key properties of [4-(2-azidoethoxy)-3-methoxyphenyl]methanol?
[4-(2-azidoethoxy)-3-methoxyphenyl]methanol has a molecular weight of 223.23 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-azidoethoxy)-3-methoxyphenyl]methanol is sourced from PubChem (CID 20769149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).