N,N-diethylazet-3-amine

C7H12N2 — CID 70423110

IUPACN,N-diethylazet-3-amine
SMILESCCN(CC)C1=CN=C1
InChIInChI=1S/C7H12N2/c1-3-9(4-2)7-5-8-6-7/h5-6H,3-4H2,1-2H3
InChIKeyHZWLONNFGUXODT-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.25
Rot. Bonds3

About N,N-diethylazet-3-amine

N,N-diethylazet-3-amine (PubChem CID 70423110) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is N,N-diethylazet-3-amine.

Molecular Properties

Compound NameN,N-diethylazet-3-amine
PubChem CID70423110
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC NameN,N-diethylazet-3-amine
SMILESCCN(CC)C1=CN=C1
InChIInChI=1S/C7H12N2/c1-3-9(4-2)7-5-8-6-7/h5-6H,3-4H2,1-2H3
InChIKeyHZWLONNFGUXODT-UHFFFAOYSA-N
XLogP1.25
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,6-Dimethylpyrazine
CID 90455649
[(Z)-2,3-bis(dimethylamino)prop-2-enylidene]-dimethylazanium chloride
CID 134893672
1,5-dimethyl-2H-pyrazine
CID 20164412
1-Methyl-2-methylidenepyrazine
CID 57557995
2-Methylidene-1-propan-2-ylpyrazine
CID 59517235
1,5-Dimethyl-2-methylidenepyrazine
CID 60079390
1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine
CID 89345683
N,N-dimethyl-3-methyliminoprop-1-en-2-amine
CID 89398792
N-ethenyl-3-methylimino-N-propan-2-ylprop-1-en-2-amine
CID 91379689
1-ethyl-5-methyl-2H-pyrazine
CID 91488587
2-(ethylideneamino)-N,N-dimethylprop-1-en-1-amine
CID 123337113
[3-(Dimethylamino)-2-[ethyl(methyl)amino]prop-2-enylidene]-dimethylazanium
CID 123420821

Frequently Asked Questions

What is the IUPAC name of N,N-diethylazet-3-amine?
The IUPAC name of N,N-diethylazet-3-amine (CID 70423110) is N,N-diethylazet-3-amine.
What is the SMILES notation for N,N-diethylazet-3-amine?
The canonical SMILES for N,N-diethylazet-3-amine is CCN(CC)C1=CN=C1.
What is the InChIKey of N,N-diethylazet-3-amine?
The InChIKey is HZWLONNFGUXODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-3-9(4-2)7-5-8-6-7/h5-6H,3-4H2,1-2H3.
What are the key properties of N,N-diethylazet-3-amine?
N,N-diethylazet-3-amine has a molecular weight of 124.19 g/mol, XLogP of 1.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylazet-3-amine is sourced from PubChem (CID 70423110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).