1-(ethoxymethyl)-1,2,4-triazol-3-amine

C5H10N4O — CID 65369127

IUPAC1-(ethoxymethyl)-1,2,4-triazol-3-amine
SMILESCCOCn1cnc(N)n1
InChIInChI=1S/C5H10N4O/c1-2-10-4-9-3-7-5(6)8-9/h3H,2,4H2,1H3,(H2,6,8)
InChIKeyUELZVXOQZLCRGT-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.15
Rot. Bonds3

About 1-(ethoxymethyl)-1,2,4-triazol-3-amine

1-(ethoxymethyl)-1,2,4-triazol-3-amine (PubChem CID 65369127) has the molecular formula C5H10N4O and a molecular weight of 142.16 g/mol. Its IUPAC name is 1-(ethoxymethyl)-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name1-(ethoxymethyl)-1,2,4-triazol-3-amine
PubChem CID65369127
Molecular FormulaC5H10N4O
Molecular Weight142.16 g/mol
Exact Mass142.09
IUPAC Name1-(ethoxymethyl)-1,2,4-triazol-3-amine
SMILESCCOCn1cnc(N)n1
InChIInChI=1S/C5H10N4O/c1-2-10-4-9-3-7-5(6)8-9/h3H,2,4H2,1H3,(H2,6,8)
InChIKeyUELZVXOQZLCRGT-UHFFFAOYSA-N
XLogP-0.15
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(Methoxymethyl)-1H-1,2,4-triazol-3-amine
CID 26722484
1-{[2-(Trimethylsilyl)ethoxy]methyl}-1H-1,2,4-triazol-3-amine
CID 67170439
Ethyl 3-amino-1h-1,2,4-triazole-1-carboxylate
CID 292486
1-[(2,2,2-trifluoroethoxy)methyl]-1H-1,2,4-triazol-3-amine
CID 106704831
Ethyl 5-amino-1h-1,2,4-triazole-1-carboxylate
CID 292485
5-chloro-1-(ethoxymethyl)-1H-1,2,4-triazole
CID 110205620
1-Ethoxymethyl-1,2,4-triazole
CID 3823094
5-Methoxy-1-methyl-1H-1,2,4-triazol-3-amine
CID 12957664
5-Ethoxy-2-methyl-1,2,4-triazol-3-amine
CID 12957670
1-(Butoxymethyl)-1,2,4-triazole
CID 20581916
3-Ethoxy-4-methyl-1,2,4-triazole
CID 54201153
3-(2-Methoxyethoxy)-1-methyl-1,2,4-triazole
CID 67757502

Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)-1,2,4-triazol-3-amine?
The IUPAC name of 1-(ethoxymethyl)-1,2,4-triazol-3-amine (CID 65369127) is 1-(ethoxymethyl)-1,2,4-triazol-3-amine.
What is the SMILES notation for 1-(ethoxymethyl)-1,2,4-triazol-3-amine?
The canonical SMILES for 1-(ethoxymethyl)-1,2,4-triazol-3-amine is CCOCn1cnc(N)n1.
What is the InChIKey of 1-(ethoxymethyl)-1,2,4-triazol-3-amine?
The InChIKey is UELZVXOQZLCRGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O/c1-2-10-4-9-3-7-5(6)8-9/h3H,2,4H2,1H3,(H2,6,8).
What are the key properties of 1-(ethoxymethyl)-1,2,4-triazol-3-amine?
1-(ethoxymethyl)-1,2,4-triazol-3-amine has a molecular weight of 142.16 g/mol, XLogP of -0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)-1,2,4-triazol-3-amine is sourced from PubChem (CID 65369127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).