[1-(2-methylpropyl)tetrazol-5-yl]methanamine

C6H13N5 — CID 62736877

IUPAC[1-(2-methylpropyl)tetrazol-5-yl]methanamine
SMILESCC(C)Cn1nnnc1CN
InChIInChI=1S/C6H13N5/c1-5(2)4-11-6(3-7)8-9-10-11/h5H,3-4,7H2,1-2H3
InChIKeyOQMXBIOSRDQFKH-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.21
Rot. Bonds3

About [1-(2-methylpropyl)tetrazol-5-yl]methanamine

[1-(2-methylpropyl)tetrazol-5-yl]methanamine (PubChem CID 62736877) has the molecular formula C6H13N5 and a molecular weight of 155.20 g/mol. Its IUPAC name is [1-(2-methylpropyl)tetrazol-5-yl]methanamine.

Molecular Properties

Compound Name[1-(2-methylpropyl)tetrazol-5-yl]methanamine
PubChem CID62736877
Molecular FormulaC6H13N5
Molecular Weight155.20 g/mol
Exact Mass155.12
IUPAC Name[1-(2-methylpropyl)tetrazol-5-yl]methanamine
SMILESCC(C)Cn1nnnc1CN
InChIInChI=1S/C6H13N5/c1-5(2)4-11-6(3-7)8-9-10-11/h5H,3-4,7H2,1-2H3
InChIKeyOQMXBIOSRDQFKH-UHFFFAOYSA-N
XLogP-0.21
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-(2-methylpropyl)tetrazol-5-yl]methanamine?
The IUPAC name of [1-(2-methylpropyl)tetrazol-5-yl]methanamine (CID 62736877) is [1-(2-methylpropyl)tetrazol-5-yl]methanamine.
What is the SMILES notation for [1-(2-methylpropyl)tetrazol-5-yl]methanamine?
The canonical SMILES for [1-(2-methylpropyl)tetrazol-5-yl]methanamine is CC(C)Cn1nnnc1CN.
What is the InChIKey of [1-(2-methylpropyl)tetrazol-5-yl]methanamine?
The InChIKey is OQMXBIOSRDQFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N5/c1-5(2)4-11-6(3-7)8-9-10-11/h5H,3-4,7H2,1-2H3.
What are the key properties of [1-(2-methylpropyl)tetrazol-5-yl]methanamine?
[1-(2-methylpropyl)tetrazol-5-yl]methanamine has a molecular weight of 155.20 g/mol, XLogP of -0.21, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylpropyl)tetrazol-5-yl]methanamine is sourced from PubChem (CID 62736877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).