N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine

C7H14N4 — CID 20791736

IUPACN,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine
SMILESCc1cnnn1CCN(C)C
InChIInChI=1S/C7H14N4/c1-7-6-8-9-11(7)5-4-10(2)3/h6H,4-5H2,1-3H3
InChIKeyRRVFLSPBHOKOQA-UHFFFAOYSA-N
MW154.22 g/mol
LogP0.15
Rot. Bonds3

About N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine

N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine (PubChem CID 20791736) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine
PubChem CID20791736
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC NameN,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine
SMILESCc1cnnn1CCN(C)C
InChIInChI=1S/C7H14N4/c1-7-6-8-9-11(7)5-4-10(2)3/h6H,4-5H2,1-3H3
InChIKeyRRVFLSPBHOKOQA-UHFFFAOYSA-N
XLogP0.15
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 50.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,5-dimethyl-1H-1,2,3-triazole
CID 15257141
2-(4-Methyl-1H-1,2,3-triazol-1-yl)ethanamine
CID 45791271
(1-Methyl-1H-1,2,3-triazol-5-YL)methanamine
CID 55262944
(1-ethyl-1H-1,2,3-triazol-5-yl)methanamine
CID 72214389
1-(1-methyl-1H-1,2,3-triazol-5-yl)methanamine hydrochloride
CID 110209505
5-ethynyl-1-methyl-1H-1,2,3-triazole
CID 114690178
4-Methyl-1-prop-2-enyltriazole
CID 13553893
1,4-Dimethyl-1H-1,2,3-triazole
CID 15257142
1-Methyl-5-(trifluoromethyl)triazole
CID 14489355
5-(chloromethyl)-1-ethyl-1H-1,2,3-triazole hydrochloride
CID 121552995
5-(bromomethyl)-1-methyl-1H-1,2,3-triazole hydrobromide
CID 165793893
1,4-Diethyltriazole
CID 19779068

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine (CID 20791736) is N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine is Cc1cnnn1CCN(C)C.
What is the InChIKey of N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine?
The InChIKey is RRVFLSPBHOKOQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4/c1-7-6-8-9-11(7)5-4-10(2)3/h6H,4-5H2,1-3H3.
What are the key properties of N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine?
N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine has a molecular weight of 154.22 g/mol, XLogP of 0.15, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(5-methyltriazol-1-yl)ethanamine is sourced from PubChem (CID 20791736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).