[1-(cyclobutylmethyl)tetrazol-5-yl]methanamine

C7H13N5 — CID 62735575

IUPAC[1-(cyclobutylmethyl)tetrazol-5-yl]methanamine
SMILESNCc1nnnn1CC1CCC1
InChIInChI=1S/C7H13N5/c8-4-7-9-10-11-12(7)5-6-2-1-3-6/h6H,1-5,8H2
InChIKeyJIYIOTQIWKMBTR-UHFFFAOYSA-N
MW167.22 g/mol
LogP-0.07
Rot. Bonds3

About [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine

[1-(cyclobutylmethyl)tetrazol-5-yl]methanamine (PubChem CID 62735575) has the molecular formula C7H13N5 and a molecular weight of 167.22 g/mol. Its IUPAC name is [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine.

Molecular Properties

Compound Name[1-(cyclobutylmethyl)tetrazol-5-yl]methanamine
PubChem CID62735575
Molecular FormulaC7H13N5
Molecular Weight167.22 g/mol
Exact Mass167.12
IUPAC Name[1-(cyclobutylmethyl)tetrazol-5-yl]methanamine
SMILESNCc1nnnn1CC1CCC1
InChIInChI=1S/C7H13N5/c8-4-7-9-10-11-12(7)5-6-2-1-3-6/h6H,1-5,8H2
InChIKeyJIYIOTQIWKMBTR-UHFFFAOYSA-N
XLogP-0.07
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.22
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine?
The IUPAC name of [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine (CID 62735575) is [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine.
What is the SMILES notation for [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine?
The canonical SMILES for [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine is NCc1nnnn1CC1CCC1.
What is the InChIKey of [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine?
The InChIKey is JIYIOTQIWKMBTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5/c8-4-7-9-10-11-12(7)5-6-2-1-3-6/h6H,1-5,8H2.
What are the key properties of [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine?
[1-(cyclobutylmethyl)tetrazol-5-yl]methanamine has a molecular weight of 167.22 g/mol, XLogP of -0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclobutylmethyl)tetrazol-5-yl]methanamine is sourced from PubChem (CID 62735575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).