1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole

C11H24N4 — CID 123524641

IUPAC1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole
SMILESCCCCC(CCCC)C1N=NNN1C
InChIInChI=1S/C11H24N4/c1-4-6-8-10(9-7-5-2)11-12-13-14-15(11)3/h10-11H,4-9H2,1-3H3,(H,12,14)
InChIKeyHWTIDACSRUATRS-UHFFFAOYSA-N
MW212.34 g/mol
LogP3.13
Rot. Bonds7

About 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole

1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole (PubChem CID 123524641) has the molecular formula C11H24N4 and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole.

Molecular Properties

Compound Name1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole
PubChem CID123524641
Molecular FormulaC11H24N4
Molecular Weight212.34 g/mol
Exact Mass212.20
IUPAC Name1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole
SMILESCCCCC(CCCC)C1N=NNN1C
InChIInChI=1S/C11H24N4/c1-4-6-8-10(9-7-5-2)11-12-13-14-15(11)3/h10-11H,4-9H2,1-3H3,(H,12,14)
InChIKeyHWTIDACSRUATRS-UHFFFAOYSA-N
XLogP3.13
TPSA39.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole 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

1-(2-ethylhexyl)-2H-tetrazole-5-thione
CID 20780722
5-(2,3-Dimethylbutyl)-1-methyl-2,5-dihydrotetrazole
CID 91455147
5-Hexan-2-yl-1-methyl-2,5-dihydrotetrazole
CID 123257935
1-Methyl-5-octan-4-yl-2,5-dihydrotetrazole
CID 123405639
1-Tridecyl-2,5-dihydrotetrazole
CID 138578082
1-(Cyclohexylmethyl)-5-ethyl-2,5-dihydrotetrazole
CID 163582276
1-Methyl-5-(3-methylbutyl)-2,5-dihydrotetrazole
CID 169959691
1-Decyl-2,5-dihydrotetrazole
CID 170549622
1-(7-methyloctyl)-2H-tetrazole-5-thione
CID 107817074

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole?
The IUPAC name of 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole (CID 123524641) is 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole.
What is the SMILES notation for 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole?
The canonical SMILES for 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole is CCCCC(CCCC)C1N=NNN1C.
What is the InChIKey of 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole?
The InChIKey is HWTIDACSRUATRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4/c1-4-6-8-10(9-7-5-2)11-12-13-14-15(11)3/h10-11H,4-9H2,1-3H3,(H,12,14).
What are the key properties of 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole?
1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole has a molecular weight of 212.34 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-nonan-5-yl-2,5-dihydrotetrazole is sourced from PubChem (CID 123524641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).