N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine

C10H19N5 — CID 103086857

IUPACN-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1C1CC(C)C1
InChIInChI=1S/C10H19N5/c1-4-11-8(3)10-12-13-14-15(10)9-5-7(2)6-9/h7-9,11H,4-6H2,1-3H3
InChIKeyCOZVSEBJVKKUMU-UHFFFAOYSA-N
MW209.30 g/mol
LogP1.31
Rot. Bonds4

About N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine

N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine (PubChem CID 103086857) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine
PubChem CID103086857
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC NameN-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1C1CC(C)C1
InChIInChI=1S/C10H19N5/c1-4-11-8(3)10-12-13-14-15(10)9-5-7(2)6-9/h7-9,11H,4-6H2,1-3H3
InChIKeyCOZVSEBJVKKUMU-UHFFFAOYSA-N
XLogP1.31
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine?
The IUPAC name of N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine (CID 103086857) is N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine is CCNC(C)c1nnnn1C1CC(C)C1.
What is the InChIKey of N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine?
The InChIKey is COZVSEBJVKKUMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5/c1-4-11-8(3)10-12-13-14-15(10)9-5-7(2)6-9/h7-9,11H,4-6H2,1-3H3.
What are the key properties of N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine?
N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine has a molecular weight of 209.30 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine is sourced from PubChem (CID 103086857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).