2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide

C5H10N6O — CID 79506797

IUPAC2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide
SMILESCN(C)C(=O)Cn1nnnc1N
InChIInChI=1S/C5H10N6O/c1-10(2)4(12)3-11-5(6)7-8-9-11/h3H2,1-2H3,(H2,6,7,9)
InChIKeyIPCHUNHDTKPGBP-UHFFFAOYSA-N
MW170.18 g/mol
LogP-1.66
Rot. Bonds2

About 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide

2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide (PubChem CID 79506797) has the molecular formula C5H10N6O and a molecular weight of 170.18 g/mol. Its IUPAC name is 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide
PubChem CID79506797
Molecular FormulaC5H10N6O
Molecular Weight170.18 g/mol
Exact Mass170.09
IUPAC Name2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide
SMILESCN(C)C(=O)Cn1nnnc1N
InChIInChI=1S/C5H10N6O/c1-10(2)4(12)3-11-5(6)7-8-9-11/h3H2,1-2H3,(H2,6,7,9)
InChIKeyIPCHUNHDTKPGBP-UHFFFAOYSA-N
XLogP-1.66
TPSA89.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.18
LogP ≤ 5-1.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide?
The IUPAC name of 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide (CID 79506797) is 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide?
The canonical SMILES for 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide is CN(C)C(=O)Cn1nnnc1N.
What is the InChIKey of 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide?
The InChIKey is IPCHUNHDTKPGBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N6O/c1-10(2)4(12)3-11-5(6)7-8-9-11/h3H2,1-2H3,(H2,6,7,9).
What are the key properties of 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide?
2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide has a molecular weight of 170.18 g/mol, XLogP of -1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-aminotetrazol-1-yl)-N,N-dimethylacetamide is sourced from PubChem (CID 79506797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).