4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine

C7H15N5 — CID 10241215

IUPAC4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine
SMILESCC(C)CC(CN)c1nn[nH]n1
InChIInChI=1S/C7H15N5/c1-5(2)3-6(4-8)7-9-11-12-10-7/h5-6H,3-4,8H2,1-2H3,(H,9,10,11,12)
InChIKeyGLDMUCZFXZKUPF-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.29
Rot. Bonds4

About 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine

4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine (PubChem CID 10241215) has the molecular formula C7H15N5 and a molecular weight of 169.23 g/mol. Its IUPAC name is 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine.

Molecular Properties

Compound Name4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine
PubChem CID10241215
Molecular FormulaC7H15N5
Molecular Weight169.23 g/mol
Exact Mass169.13
IUPAC Name4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine
SMILESCC(C)CC(CN)c1nn[nH]n1
InChIInChI=1S/C7H15N5/c1-5(2)3-6(4-8)7-9-11-12-10-7/h5-6H,3-4,8H2,1-2H3,(H,9,10,11,12)
InChIKeyGLDMUCZFXZKUPF-UHFFFAOYSA-N
XLogP0.29
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine?
The IUPAC name of 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine (CID 10241215) is 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine.
What is the SMILES notation for 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine?
The canonical SMILES for 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine is CC(C)CC(CN)c1nn[nH]n1.
What is the InChIKey of 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine?
The InChIKey is GLDMUCZFXZKUPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N5/c1-5(2)3-6(4-8)7-9-11-12-10-7/h5-6H,3-4,8H2,1-2H3,(H,9,10,11,12).
What are the key properties of 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine?
4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine has a molecular weight of 169.23 g/mol, XLogP of 0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2H-tetrazol-5-yl)pentan-1-amine is sourced from PubChem (CID 10241215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).