N-ethyl-N-methyl-2H-triazol-4-amine

C5H10N4 — CID 69162370

IUPACN-ethyl-N-methyl-2H-triazol-4-amine
SMILESCCN(C)c1cn[nH]n1
InChIInChI=1S/C5H10N4/c1-3-9(2)5-4-6-8-7-5/h4H,3H2,1-2H3,(H,6,7,8)
InChIKeyRROZAULINRYDNQ-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.26
Rot. Bonds2

About N-ethyl-N-methyl-2H-triazol-4-amine

N-ethyl-N-methyl-2H-triazol-4-amine (PubChem CID 69162370) has the molecular formula C5H10N4 and a molecular weight of 126.16 g/mol. Its IUPAC name is N-ethyl-N-methyl-2H-triazol-4-amine.

Molecular Properties

Compound NameN-ethyl-N-methyl-2H-triazol-4-amine
PubChem CID69162370
Molecular FormulaC5H10N4
Molecular Weight126.16 g/mol
Exact Mass126.09
IUPAC NameN-ethyl-N-methyl-2H-triazol-4-amine
SMILESCCN(C)c1cn[nH]n1
InChIInChI=1S/C5H10N4/c1-3-9(2)5-4-6-8-7-5/h4H,3H2,1-2H3,(H,6,7,8)
InChIKeyRROZAULINRYDNQ-UHFFFAOYSA-N
XLogP0.26
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2H-triazol-4-amine?
The IUPAC name of N-ethyl-N-methyl-2H-triazol-4-amine (CID 69162370) is N-ethyl-N-methyl-2H-triazol-4-amine.
What is the SMILES notation for N-ethyl-N-methyl-2H-triazol-4-amine?
The canonical SMILES for N-ethyl-N-methyl-2H-triazol-4-amine is CCN(C)c1cn[nH]n1.
What is the InChIKey of N-ethyl-N-methyl-2H-triazol-4-amine?
The InChIKey is RROZAULINRYDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4/c1-3-9(2)5-4-6-8-7-5/h4H,3H2,1-2H3,(H,6,7,8).
What are the key properties of N-ethyl-N-methyl-2H-triazol-4-amine?
N-ethyl-N-methyl-2H-triazol-4-amine has a molecular weight of 126.16 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2H-triazol-4-amine is sourced from PubChem (CID 69162370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).