2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide

C11H14N6O3 — CID 961497

IUPAC2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide
SMILESCOc1cc(CNc2nn[nH]n2)ccc1OCC(N)=O
InChIInChI=1S/C11H14N6O3/c1-19-9-4-7(5-13-11-14-16-17-15-11)2-3-8(9)20-6-10(12)18/h2-4H,5-6H2,1H3,(H2,12,18)(H2,13,14,15,16,17)
InChIKeyCHCNQYOOXJECAY-UHFFFAOYSA-N
MW278.27 g/mol
LogP-0.32
Rot. Bonds7

About 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide

2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide (PubChem CID 961497) has the molecular formula C11H14N6O3 and a molecular weight of 278.27 g/mol. Its IUPAC name is 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide
PubChem CID961497
Molecular FormulaC11H14N6O3
Molecular Weight278.27 g/mol
Exact Mass278.11
IUPAC Name2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide
SMILESCOc1cc(CNc2nn[nH]n2)ccc1OCC(N)=O
InChIInChI=1S/C11H14N6O3/c1-19-9-4-7(5-13-11-14-16-17-15-11)2-3-8(9)20-6-10(12)18/h2-4H,5-6H2,1H3,(H2,12,18)(H2,13,14,15,16,17)
InChIKeyCHCNQYOOXJECAY-UHFFFAOYSA-N
XLogP-0.32
TPSA128.04 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.27
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide 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

N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-methyltetrazol-5-amine
CID 4725761
2-(4-{[(5-amino-1H-tetrazol-1-yl)amino]methyl}-2-methoxyphenoxy)-N-(tert-butyl)acetamide
CID 834094
N-tert-butyl-2-[2-methoxy-4-[(1H-1,2,4-triazol-5-ylamino)methyl]phenoxy]acetamide
CID 834091
(3,4-Dimethoxy-benzyl)-(1H-tetrazol-5-yl)-amine
CID 592205
(4-Allyloxy-benzyl)-(2H-tetrazol-5-yl)-amine
CID 655020
o-veratryl(2H-tetrazol-5-yl)amine
CID 834328
N-tert-butyl-2-[2-ethoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide
CID 964347
2-(4-{[(5-amino-1H-tetraazol-1-yl)amino]methyl}-2-ethoxyphenoxy)-N-(tert-butyl)acetamide
CID 1017334
N-tert-butyl-2-{2-ethoxy-4-[(1H-1,2,4-triazol-3-ylamino)methyl]phenoxy}acetamide
CID 2200299
(4-Allyloxy-3-methoxy-benzyl)-(2H-tetrazol-5-yl)-amine
CID 2219224
N-{3-methoxy-4-[(3-methylbenzyl)oxy]benzyl}-1H-tetrazol-5-amine
CID 4725559
N-{3-methoxy-4-[(4-methylbenzyl)oxy]benzyl}-1H-tetrazol-5-amine
CID 4725560

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide?
The IUPAC name of 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide (CID 961497) is 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide?
The canonical SMILES for 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide is COc1cc(CNc2nn[nH]n2)ccc1OCC(N)=O.
What is the InChIKey of 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide?
The InChIKey is CHCNQYOOXJECAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O3/c1-19-9-4-7(5-13-11-14-16-17-15-11)2-3-8(9)20-6-10(12)18/h2-4H,5-6H2,1H3,(H2,12,18)(H2,13,14,15,16,17).
What are the key properties of 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide?
2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide has a molecular weight of 278.27 g/mol, XLogP of -0.32, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide is sourced from PubChem (CID 961497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).