1-(cyclohexylmethyl)-5-ethyltetrazole

C10H18N4 — CID 59428610

IUPAC1-(cyclohexylmethyl)-5-ethyltetrazole
SMILESCCc1nnnn1CC1CCCCC1
InChIInChI=1S/C10H18N4/c1-2-10-11-12-13-14(10)8-9-6-4-3-5-7-9/h9H,2-8H2,1H3
InChIKeyCRJQLLHZUUURCO-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.82
Rot. Bonds3

About 1-(cyclohexylmethyl)-5-ethyltetrazole

1-(cyclohexylmethyl)-5-ethyltetrazole (PubChem CID 59428610) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)-5-ethyltetrazole.

Molecular Properties

Compound Name1-(cyclohexylmethyl)-5-ethyltetrazole
PubChem CID59428610
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-(cyclohexylmethyl)-5-ethyltetrazole
SMILESCCc1nnnn1CC1CCCCC1
InChIInChI=1S/C10H18N4/c1-2-10-11-12-13-14(10)8-9-6-4-3-5-7-9/h9H,2-8H2,1H3
InChIKeyCRJQLLHZUUURCO-UHFFFAOYSA-N
XLogP1.82
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)-5-ethyltetrazole?
The IUPAC name of 1-(cyclohexylmethyl)-5-ethyltetrazole (CID 59428610) is 1-(cyclohexylmethyl)-5-ethyltetrazole.
What is the SMILES notation for 1-(cyclohexylmethyl)-5-ethyltetrazole?
The canonical SMILES for 1-(cyclohexylmethyl)-5-ethyltetrazole is CCc1nnnn1CC1CCCCC1.
What is the InChIKey of 1-(cyclohexylmethyl)-5-ethyltetrazole?
The InChIKey is CRJQLLHZUUURCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-2-10-11-12-13-14(10)8-9-6-4-3-5-7-9/h9H,2-8H2,1H3.
What are the key properties of 1-(cyclohexylmethyl)-5-ethyltetrazole?
1-(cyclohexylmethyl)-5-ethyltetrazole has a molecular weight of 194.28 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)-5-ethyltetrazole is sourced from PubChem (CID 59428610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).