1,2,4-trimethyl-1,2,4-triazolidin-3-amine

C5H14N4 — CID 123278037

IUPAC1,2,4-trimethyl-1,2,4-triazolidin-3-amine
SMILESCN1CN(C)N(C)C1N
InChIInChI=1S/C5H14N4/c1-7-4-8(2)9(3)5(7)6/h5H,4,6H2,1-3H3
InChIKeyXRAAEBPZZHRZEH-UHFFFAOYSA-N
MW130.19 g/mol
LogP-1.09
Rot. Bonds

About 1,2,4-trimethyl-1,2,4-triazolidin-3-amine

1,2,4-trimethyl-1,2,4-triazolidin-3-amine (PubChem CID 123278037) has the molecular formula C5H14N4 and a molecular weight of 130.19 g/mol. Its IUPAC name is 1,2,4-trimethyl-1,2,4-triazolidin-3-amine.

Molecular Properties

Compound Name1,2,4-trimethyl-1,2,4-triazolidin-3-amine
PubChem CID123278037
Molecular FormulaC5H14N4
Molecular Weight130.19 g/mol
Exact Mass130.12
IUPAC Name1,2,4-trimethyl-1,2,4-triazolidin-3-amine
SMILESCN1CN(C)N(C)C1N
InChIInChI=1S/C5H14N4/c1-7-4-8(2)9(3)5(7)6/h5H,4,6H2,1-3H3
InChIKeyXRAAEBPZZHRZEH-UHFFFAOYSA-N
XLogP-1.09
TPSA35.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-1.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,3,5-trimethyl-1,3,5-triazinan-2-amine
CID 174832222
1,3-dimethyl-1,3-diazinan-2-amine
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3,5,8,10-tetramethyl-3,5,8,10-tetrazatricyclo[5.3.0.02,6]decane
CID 10584056
azane;1,2-dimethylpyrrolidin-3-amine
CID 175027569
1,2,3,4-tetramethylpiperazine
CID 66583347
1,2,3,4-tetramethylpyrazolidine
CID 91568324
1,3-dimethyl-2,4-dihydropyrimidine-4,5-diamine
CID 131871119
(2R)-1-methyl-2-propan-2-ylaziridine
CID 140882357
1-(2-methoxyethyl)piperidin-4-amine;hydrochloride
CID 146675245
1,6-dimethylpiperidine-3,4-diamine
CID 82417846
4,6-dimethoxy-1,3-dimethyl-1,3-diazinan-2-amine
CID 152969309
(3S)-3-amino-1-methylazetidin-2-one;hydron
CID 131858386

Frequently Asked Questions

What is the IUPAC name of 1,2,4-trimethyl-1,2,4-triazolidin-3-amine?
The IUPAC name of 1,2,4-trimethyl-1,2,4-triazolidin-3-amine (CID 123278037) is 1,2,4-trimethyl-1,2,4-triazolidin-3-amine.
What is the SMILES notation for 1,2,4-trimethyl-1,2,4-triazolidin-3-amine?
The canonical SMILES for 1,2,4-trimethyl-1,2,4-triazolidin-3-amine is CN1CN(C)N(C)C1N.
What is the InChIKey of 1,2,4-trimethyl-1,2,4-triazolidin-3-amine?
The InChIKey is XRAAEBPZZHRZEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N4/c1-7-4-8(2)9(3)5(7)6/h5H,4,6H2,1-3H3.
What are the key properties of 1,2,4-trimethyl-1,2,4-triazolidin-3-amine?
1,2,4-trimethyl-1,2,4-triazolidin-3-amine has a molecular weight of 130.19 g/mol, XLogP of -1.09, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4-trimethyl-1,2,4-triazolidin-3-amine is sourced from PubChem (CID 123278037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).