(3,4-dimethyl-2H-tetrazol-5-yl)methanamine

C4H11N5 — CID 119095754

IUPAC(3,4-dimethyl-2H-tetrazol-5-yl)methanamine
SMILESCN1NN=C(CN)N1C
InChIInChI=1S/C4H11N5/c1-8-4(3-5)6-7-9(8)2/h7H,3,5H2,1-2H3
InChIKeyGLRLKWCAQWMYGY-UHFFFAOYSA-N
MW129.17 g/mol
LogP-1.44
Rot. Bonds1

About (3,4-dimethyl-2H-tetrazol-5-yl)methanamine

(3,4-dimethyl-2H-tetrazol-5-yl)methanamine (PubChem CID 119095754) has the molecular formula C4H11N5 and a molecular weight of 129.17 g/mol. Its IUPAC name is (3,4-dimethyl-2H-tetrazol-5-yl)methanamine.

Molecular Properties

Compound Name(3,4-dimethyl-2H-tetrazol-5-yl)methanamine
PubChem CID119095754
Molecular FormulaC4H11N5
Molecular Weight129.17 g/mol
Exact Mass129.10
IUPAC Name(3,4-dimethyl-2H-tetrazol-5-yl)methanamine
SMILESCN1NN=C(CN)N1C
InChIInChI=1S/C4H11N5/c1-8-4(3-5)6-7-9(8)2/h7H,3,5H2,1-2H3
InChIKeyGLRLKWCAQWMYGY-UHFFFAOYSA-N
XLogP-1.44
TPSA56.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.17
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3,4-dimethyl-2H-tetrazol-5-yl)methanamine?
The IUPAC name of (3,4-dimethyl-2H-tetrazol-5-yl)methanamine (CID 119095754) is (3,4-dimethyl-2H-tetrazol-5-yl)methanamine.
What is the SMILES notation for (3,4-dimethyl-2H-tetrazol-5-yl)methanamine?
The canonical SMILES for (3,4-dimethyl-2H-tetrazol-5-yl)methanamine is CN1NN=C(CN)N1C.
What is the InChIKey of (3,4-dimethyl-2H-tetrazol-5-yl)methanamine?
The InChIKey is GLRLKWCAQWMYGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N5/c1-8-4(3-5)6-7-9(8)2/h7H,3,5H2,1-2H3.
What are the key properties of (3,4-dimethyl-2H-tetrazol-5-yl)methanamine?
(3,4-dimethyl-2H-tetrazol-5-yl)methanamine has a molecular weight of 129.17 g/mol, XLogP of -1.44, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethyl-2H-tetrazol-5-yl)methanamine is sourced from PubChem (CID 119095754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).