3-(5-methyltetrazol-2-yl)propylazanium

C5H12N5+ — CID 169320357

IUPAC3-(5-methyltetrazol-2-yl)propylazanium
SMILESCc1nnn(CCC[NH3+])n1
InChIInChI=1S/C5H11N5/c1-5-7-9-10(8-5)4-2-3-6/h2-4,6H2,1H3/p+1
InChIKeyYAQNCPXWRJYTPH-UHFFFAOYSA-O
MW142.19 g/mol
LogP-1.39
Rot. Bonds3

About 3-(5-methyltetrazol-2-yl)propylazanium

3-(5-methyltetrazol-2-yl)propylazanium (PubChem CID 169320357) has the molecular formula C5H12N5+ and a molecular weight of 142.19 g/mol. Its IUPAC name is 3-(5-methyltetrazol-2-yl)propylazanium.

Molecular Properties

Compound Name3-(5-methyltetrazol-2-yl)propylazanium
PubChem CID169320357
Molecular FormulaC5H12N5+
Molecular Weight142.19 g/mol
Exact Mass142.11
IUPAC Name3-(5-methyltetrazol-2-yl)propylazanium
SMILESCc1nnn(CCC[NH3+])n1
InChIInChI=1S/C5H11N5/c1-5-7-9-10(8-5)4-2-3-6/h2-4,6H2,1H3/p+1
InChIKeyYAQNCPXWRJYTPH-UHFFFAOYSA-O
XLogP-1.39
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.19
LogP ≤ 5-1.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluoroethyl)-5-methyltetrazole
CID 20644902
2-methyl-1-(5-methyltetrazol-2-yl)propan-2-amine
CID 91620131
5-methyl-1-[4-(4-methylphenyl)butyl]tetrazole;5-methyl-2-[4-(4-methylphenyl)butyl]tetrazole
CID 163989935
2-(5-propan-2-yltetrazol-2-yl)ethylazanium
CID 162510105
tert-butyl N-[2-(5-methyltetrazol-2-yl)ethyl]carbamate
CID 90148596
2,5-dimethyltetrazole;ethane
CID 90989742
2-butyl-5-propyltetrazole
CID 69034353
4,4-difluorobut-3-enyl 2-(5-methyltetrazol-2-yl)acetate
CID 163220391
5-methyl-2-[(5-methylthiophen-2-yl)methyl]tetrazole
CID 89032223
4-[(5-methyltetrazol-2-yl)methyl]benzonitrile
CID 142243582
2-butyl-5-(trichloromethyl)tetrazole
CID 69031638
(5-methyltetrazol-2-yl)methyl 2-methylprop-2-enoate
CID 66795799

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyltetrazol-2-yl)propylazanium?
The IUPAC name of 3-(5-methyltetrazol-2-yl)propylazanium (CID 169320357) is 3-(5-methyltetrazol-2-yl)propylazanium.
What is the SMILES notation for 3-(5-methyltetrazol-2-yl)propylazanium?
The canonical SMILES for 3-(5-methyltetrazol-2-yl)propylazanium is Cc1nnn(CCC[NH3+])n1.
What is the InChIKey of 3-(5-methyltetrazol-2-yl)propylazanium?
The InChIKey is YAQNCPXWRJYTPH-UHFFFAOYSA-O. The full InChI is InChI=1S/C5H11N5/c1-5-7-9-10(8-5)4-2-3-6/h2-4,6H2,1H3/p+1.
What are the key properties of 3-(5-methyltetrazol-2-yl)propylazanium?
3-(5-methyltetrazol-2-yl)propylazanium has a molecular weight of 142.19 g/mol, XLogP of -1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyltetrazol-2-yl)propylazanium is sourced from PubChem (CID 169320357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).