2-methyl-5-(2-propylpentyl)tetrazole

C10H20N4 — CID 143471667

IUPAC2-methyl-5-(2-propylpentyl)tetrazole
SMILESCCCC(CCC)Cc1nnn(C)n1
InChIInChI=1S/C10H20N4/c1-4-6-9(7-5-2)8-10-11-13-14(3)12-10/h9H,4-8H2,1-3H3
InChIKeyKXIOPQYFXVPGFO-UHFFFAOYSA-N
MW196.30 g/mol
LogP1.97
Rot. Bonds6

About 2-methyl-5-(2-propylpentyl)tetrazole

2-methyl-5-(2-propylpentyl)tetrazole (PubChem CID 143471667) has the molecular formula C10H20N4 and a molecular weight of 196.30 g/mol. Its IUPAC name is 2-methyl-5-(2-propylpentyl)tetrazole.

Molecular Properties

Compound Name2-methyl-5-(2-propylpentyl)tetrazole
PubChem CID143471667
Molecular FormulaC10H20N4
Molecular Weight196.30 g/mol
Exact Mass196.17
IUPAC Name2-methyl-5-(2-propylpentyl)tetrazole
SMILESCCCC(CCC)Cc1nnn(C)n1
InChIInChI=1S/C10H20N4/c1-4-6-9(7-5-2)8-10-11-13-14(3)12-10/h9H,4-8H2,1-3H3
InChIKeyKXIOPQYFXVPGFO-UHFFFAOYSA-N
XLogP1.97
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.30
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-propylpentyl)tetrazole?
The IUPAC name of 2-methyl-5-(2-propylpentyl)tetrazole (CID 143471667) is 2-methyl-5-(2-propylpentyl)tetrazole.
What is the SMILES notation for 2-methyl-5-(2-propylpentyl)tetrazole?
The canonical SMILES for 2-methyl-5-(2-propylpentyl)tetrazole is CCCC(CCC)Cc1nnn(C)n1.
What is the InChIKey of 2-methyl-5-(2-propylpentyl)tetrazole?
The InChIKey is KXIOPQYFXVPGFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4/c1-4-6-9(7-5-2)8-10-11-13-14(3)12-10/h9H,4-8H2,1-3H3.
What are the key properties of 2-methyl-5-(2-propylpentyl)tetrazole?
2-methyl-5-(2-propylpentyl)tetrazole has a molecular weight of 196.30 g/mol, XLogP of 1.97, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-propylpentyl)tetrazole is sourced from PubChem (CID 143471667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).