4-(methoxymethyl)-N,N-dimethyltriazol-1-amine

C6H12N4O — CID 166858592

IUPAC4-(methoxymethyl)-N,N-dimethyltriazol-1-amine
SMILESCOCc1cn(N(C)C)nn1
InChIInChI=1S/C6H12N4O/c1-9(2)10-4-6(5-11-3)7-8-10/h4H,5H2,1-3H3
InChIKeyKUZKHCNHVHIPKL-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.38
Rot. Bonds3

About 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine

4-(methoxymethyl)-N,N-dimethyltriazol-1-amine (PubChem CID 166858592) has the molecular formula C6H12N4O and a molecular weight of 156.19 g/mol. Its IUPAC name is 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine.

Molecular Properties

Compound Name4-(methoxymethyl)-N,N-dimethyltriazol-1-amine
PubChem CID166858592
Molecular FormulaC6H12N4O
Molecular Weight156.19 g/mol
Exact Mass156.10
IUPAC Name4-(methoxymethyl)-N,N-dimethyltriazol-1-amine
SMILESCOCc1cn(N(C)C)nn1
InChIInChI=1S/C6H12N4O/c1-9(2)10-4-6(5-11-3)7-8-10/h4H,5H2,1-3H3
InChIKeyKUZKHCNHVHIPKL-UHFFFAOYSA-N
XLogP-0.38
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(dimethylamino)-5-[[4-(methoxymethyl)triazol-1-yl]methyl]cyclopentane-1,2-diol
CID 162793126
2-[(1R)-1-[4-(methoxymethyl)triazol-1-yl]ethyl]pyridine
CID 139019613
[4-(methoxymethyl)triazol-1-yl]-morpholin-4-ylmethanone
CID 122218061
(3R)-3-[4-(methoxymethyl)triazol-1-yl]piperidine
CID 129494266
ethane;2-[2-[2-[2-[4-(methoxymethyl)triazol-1-yl]ethoxy]ethoxy]ethoxy]-N-methylethanamine
CID 144977278
1-[[3-(cyclopentylmethyl)cyclopentyl]methyl]-4-(methoxymethyl)triazole
CID 123822821
1-(4-hexylphenyl)-4-(methoxymethyl)triazole
CID 121373808
4-(1-methoxyethoxymethyl)-1-methyltriazole
CID 174763188
2-[[4-(methoxymethyl)triazol-1-yl]methyl]-1H-benzimidazole
CID 139019671
ethane;ethanol;hydrogen peroxide;4-(methoxymethyl)-1-(2,2,4-trimethylpentyl)triazole
CID 167448164
1-[4-(5,5-dimethylhexyl)phenyl]-4-(methoxymethyl)triazole
CID 59154760
2-[2-[4-(methoxymethyl)triazol-1-yl]ethyl]isoquinolin-1-one
CID 138051958

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine?
The IUPAC name of 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine (CID 166858592) is 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine.
What is the SMILES notation for 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine?
The canonical SMILES for 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine is COCc1cn(N(C)C)nn1.
What is the InChIKey of 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine?
The InChIKey is KUZKHCNHVHIPKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O/c1-9(2)10-4-6(5-11-3)7-8-10/h4H,5H2,1-3H3.
What are the key properties of 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine?
4-(methoxymethyl)-N,N-dimethyltriazol-1-amine has a molecular weight of 156.19 g/mol, XLogP of -0.38, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N,N-dimethyltriazol-1-amine is sourced from PubChem (CID 166858592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).