1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine

C8H17N5 — CID 63150236

IUPAC1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine
SMILESCCC(C)C(C)Nc1nnnn1C
InChIInChI=1S/C8H17N5/c1-5-6(2)7(3)9-8-10-11-12-13(8)4/h6-7H,5H2,1-4H3,(H,9,10,12)
InChIKeyPZRRYTPSCYFJOJ-UHFFFAOYSA-N
MW183.26 g/mol
LogP1.06
Rot. Bonds4

About 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine

1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine (PubChem CID 63150236) has the molecular formula C8H17N5 and a molecular weight of 183.26 g/mol. Its IUPAC name is 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine.

Molecular Properties

Compound Name1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine
PubChem CID63150236
Molecular FormulaC8H17N5
Molecular Weight183.26 g/mol
Exact Mass183.15
IUPAC Name1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine
SMILESCCC(C)C(C)Nc1nnnn1C
InChIInChI=1S/C8H17N5/c1-5-6(2)7(3)9-8-10-11-12-13(8)4/h6-7H,5H2,1-4H3,(H,9,10,12)
InChIKeyPZRRYTPSCYFJOJ-UHFFFAOYSA-N
XLogP1.06
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.26
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine?
The IUPAC name of 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine (CID 63150236) is 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine.
What is the SMILES notation for 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine?
The canonical SMILES for 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine is CCC(C)C(C)Nc1nnnn1C.
What is the InChIKey of 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine?
The InChIKey is PZRRYTPSCYFJOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N5/c1-5-6(2)7(3)9-8-10-11-12-13(8)4/h6-7H,5H2,1-4H3,(H,9,10,12).
What are the key properties of 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine?
1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine has a molecular weight of 183.26 g/mol, XLogP of 1.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(3-methylpentan-2-yl)tetrazol-5-amine is sourced from PubChem (CID 63150236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).