1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine

C8H15N5 — CID 107049334

IUPAC1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCn1nnc(CC(N)C2CCC2)n1
InChIInChI=1S/C8H15N5/c1-13-11-8(10-12-13)5-7(9)6-3-2-4-6/h6-7H,2-5,9H2,1H3
InChIKeyOKCPAFHYHWRQMR-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.12
Rot. Bonds3

About 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine

1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine (PubChem CID 107049334) has the molecular formula C8H15N5 and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine
PubChem CID107049334
Molecular FormulaC8H15N5
Molecular Weight181.24 g/mol
Exact Mass181.13
IUPAC Name1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCn1nnc(CC(N)C2CCC2)n1
InChIInChI=1S/C8H15N5/c1-13-11-8(10-12-13)5-7(9)6-3-2-4-6/h6-7H,2-5,9H2,1H3
InChIKeyOKCPAFHYHWRQMR-UHFFFAOYSA-N
XLogP-0.12
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclohexyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048433
1-cyclopentyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107044748
1-(1,1-dioxothiolan-3-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050587
2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine
CID 107049445
1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050394
2-(2-methyltetrazol-5-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 107049596
[1-(3-ethylcyclohexyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066163
2-(2-methyltetrazol-5-yl)-1-(7-oxabicyclo[2.2.1]heptan-2-yl)ethanamine
CID 107049273
N-[1-cyclohexyl-2-(2-methyltetrazol-5-yl)ethyl]propan-1-amine
CID 107048630
[4-cyclopentyl-1-(2-methyltetrazol-5-yl)butan-2-yl]hydrazine
CID 107066854
1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 131062453
5-(3-chloro-2-methylbutyl)-2-methyltetrazole
CID 107052382

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine?
The IUPAC name of 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine (CID 107049334) is 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine.
What is the SMILES notation for 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine?
The canonical SMILES for 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine is Cn1nnc(CC(N)C2CCC2)n1.
What is the InChIKey of 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine?
The InChIKey is OKCPAFHYHWRQMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5/c1-13-11-8(10-12-13)5-7(9)6-3-2-4-6/h6-7H,2-5,9H2,1H3.
What are the key properties of 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine?
1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine has a molecular weight of 181.24 g/mol, XLogP of -0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine is sourced from PubChem (CID 107049334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).