ethane;1,2,4-trimethyl-1,2,4-triazolidine

C7H19N3 — CID 123525370

IUPACethane;1,2,4-trimethyl-1,2,4-triazolidine
SMILESCC.CN1CN(C)N(C)C1
InChIInChI=1S/C5H13N3.C2H6/c1-6-4-7(2)8(3)5-6;1-2/h4-5H2,1-3H3;1-2H3
InChIKeyRXSVLVKBOJDNET-UHFFFAOYSA-N
MW145.25 g/mol
LogP0.65
Rot. Bonds

About ethane;1,2,4-trimethyl-1,2,4-triazolidine

ethane;1,2,4-trimethyl-1,2,4-triazolidine (PubChem CID 123525370) has the molecular formula C7H19N3 and a molecular weight of 145.25 g/mol. Its IUPAC name is ethane;1,2,4-trimethyl-1,2,4-triazolidine.

Molecular Properties

Compound Nameethane;1,2,4-trimethyl-1,2,4-triazolidine
PubChem CID123525370
Molecular FormulaC7H19N3
Molecular Weight145.25 g/mol
Exact Mass145.16
IUPAC Nameethane;1,2,4-trimethyl-1,2,4-triazolidine
SMILESCC.CN1CN(C)N(C)C1
InChIInChI=1S/C5H13N3.C2H6/c1-6-4-7(2)8(3)5-6;1-2/h4-5H2,1-3H3;1-2H3
InChIKeyRXSVLVKBOJDNET-UHFFFAOYSA-N
XLogP0.65
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;1,2,4-trimethyl-1,2,4-triazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzene;1,3-dimethyl-1,3-diazetidine;ethane
CID 167591443
1,3,5-trimethyl-1,3,5-triazecane
CID 154027653
1-methyl-3,5-di(propan-2-yl)-1,3,5-triazinane
CID 15402375
trichlorochromium(1+);1,3,5-trimethyl-1,3,5-triazinane
CID 87195451
1,4-dimethylpiperazine;ethane
CID 91292414
1,3-dimethyl-1,3-diazetidine;1,3-dimethyl-1,3-diazinane;1,4-dimethylpiperazine;methane
CID 157314435
3,5-dimethyl-1,3,5-triazinan-1-amine
CID 141002820
1-tert-butyl-3-methylimidazolidine
CID 89297174
1,3,6-trimethyl-1,3,6-triazecane
CID 154027654
1-(3-methylimidazolidin-1-yl)ethanol
CID 122204865
ethane;bis(1-methylpyrrolidine)
CID 153385238
1,3,5-trimethyl-1,3,5-triazinan-2-amine
CID 174832222

Frequently Asked Questions

What is the IUPAC name of ethane;1,2,4-trimethyl-1,2,4-triazolidine?
The IUPAC name of ethane;1,2,4-trimethyl-1,2,4-triazolidine (CID 123525370) is ethane;1,2,4-trimethyl-1,2,4-triazolidine.
What is the SMILES notation for ethane;1,2,4-trimethyl-1,2,4-triazolidine?
The canonical SMILES for ethane;1,2,4-trimethyl-1,2,4-triazolidine is CC.CN1CN(C)N(C)C1.
What is the InChIKey of ethane;1,2,4-trimethyl-1,2,4-triazolidine?
The InChIKey is RXSVLVKBOJDNET-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3.C2H6/c1-6-4-7(2)8(3)5-6;1-2/h4-5H2,1-3H3;1-2H3.
What are the key properties of ethane;1,2,4-trimethyl-1,2,4-triazolidine?
ethane;1,2,4-trimethyl-1,2,4-triazolidine has a molecular weight of 145.25 g/mol, XLogP of 0.65, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1,2,4-trimethyl-1,2,4-triazolidine is sourced from PubChem (CID 123525370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).