N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine

C14H24N6O — CID 81333906

IUPACN-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine
SMILESCc1cc(OCCn2cc(CNC(C)(C)C)nn2)n(C)n1
InChIInChI=1S/C14H24N6O/c1-11-8-13(19(5)17-11)21-7-6-20-10-12(16-18-20)9-15-14(2,3)4/h8,10,15H,6-7,9H2,1-5H3
InChIKeyPYKXAVQFKAYOCX-UHFFFAOYSA-N
MW292.39 g/mol
LogP1.29
Rot. Bonds6

About N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine

N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine (PubChem CID 81333906) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine
PubChem CID81333906
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC NameN-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine
SMILESCc1cc(OCCn2cc(CNC(C)(C)C)nn2)n(C)n1
InChIInChI=1S/C14H24N6O/c1-11-8-13(19(5)17-11)21-7-6-20-10-12(16-18-20)9-15-14(2,3)4/h8,10,15H,6-7,9H2,1-5H3
InChIKeyPYKXAVQFKAYOCX-UHFFFAOYSA-N
XLogP1.29
TPSA69.79 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine with MolForge

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Related Compounds

N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-1-(2-methylpyrazol-3-yl)methanamine
CID 51105022
1-[2-[1-Methyl-5-(trifluoromethyl)pyrazol-3-yl]oxyethyl]pyrazol-4-amine
CID 117989217
1-methyl-3-[(1-methyl-1H-pyrazol-5-yl)methoxy]-1H-pyrazol-4-amine
CID 66509591
N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-1-(2-methylpropyl)pyrazol-4-amine
CID 75434874
N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-1-amine
CID 81332952
N-[[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]ethyl]triazol-4-yl]methyl]propan-2-amine
CID 81341212
2-methyl-N-[[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]ethyl]triazol-4-yl]methyl]propan-1-amine
CID 81341312
5-(2,5-Dimethylpyrazol-3-yl)oxy-1-ethyl-3-methylpyrazol-4-amine
CID 81341341
2-methyl-N-[[6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methyl]propan-2-amine
CID 81341397
[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]ethyl]triazol-4-yl]methanamine
CID 81341412
[3-(2,5-Dimethylpyrazol-3-yl)oxypyrazin-2-yl]methanamine
CID 81341431
2-methyl-N-[[1-[2-[(5-methyl-1H-pyrazol-3-yl)oxy]ethyl]triazol-4-yl]methyl]propan-2-amine
CID 81341872

Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine (CID 81333906) is N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine is Cc1cc(OCCn2cc(CNC(C)(C)C)nn2)n(C)n1.
What is the InChIKey of N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is PYKXAVQFKAYOCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c1-11-8-13(19(5)17-11)21-7-6-20-10-12(16-18-20)9-15-14(2,3)4/h8,10,15H,6-7,9H2,1-5H3.
What are the key properties of N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine?
N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 292.39 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(2,5-dimethylpyrazol-3-yl)oxyethyl]triazol-4-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 81333906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).