2-(2-ethyltetrazol-5-yl)-N-methylethanamine

C6H13N5 — CID 59418794

IUPAC2-(2-ethyltetrazol-5-yl)-N-methylethanamine
SMILESCCn1nnc(CCNC)n1
InChIInChI=1S/C6H13N5/c1-3-11-9-6(8-10-11)4-5-7-2/h7H,3-5H2,1-2H3
InChIKeyUAKGNYXXELEMEV-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.55
Rot. Bonds4

About 2-(2-ethyltetrazol-5-yl)-N-methylethanamine

2-(2-ethyltetrazol-5-yl)-N-methylethanamine (PubChem CID 59418794) has the molecular formula C6H13N5 and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-(2-ethyltetrazol-5-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(2-ethyltetrazol-5-yl)-N-methylethanamine
PubChem CID59418794
Molecular FormulaC6H13N5
Molecular Weight155.20 g/mol
Exact Mass155.12
IUPAC Name2-(2-ethyltetrazol-5-yl)-N-methylethanamine
SMILESCCn1nnc(CCNC)n1
InChIInChI=1S/C6H13N5/c1-3-11-9-6(8-10-11)4-5-7-2/h7H,3-5H2,1-2H3
InChIKeyUAKGNYXXELEMEV-UHFFFAOYSA-N
XLogP-0.55
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyltetrazol-5-yl)-N-methylethanamine?
The IUPAC name of 2-(2-ethyltetrazol-5-yl)-N-methylethanamine (CID 59418794) is 2-(2-ethyltetrazol-5-yl)-N-methylethanamine.
What is the SMILES notation for 2-(2-ethyltetrazol-5-yl)-N-methylethanamine?
The canonical SMILES for 2-(2-ethyltetrazol-5-yl)-N-methylethanamine is CCn1nnc(CCNC)n1.
What is the InChIKey of 2-(2-ethyltetrazol-5-yl)-N-methylethanamine?
The InChIKey is UAKGNYXXELEMEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N5/c1-3-11-9-6(8-10-11)4-5-7-2/h7H,3-5H2,1-2H3.
What are the key properties of 2-(2-ethyltetrazol-5-yl)-N-methylethanamine?
2-(2-ethyltetrazol-5-yl)-N-methylethanamine has a molecular weight of 155.20 g/mol, XLogP of -0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyltetrazol-5-yl)-N-methylethanamine is sourced from PubChem (CID 59418794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).