1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride

C11H22ClN5 — CID 3031883

IUPAC1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride
SMILESCCN(CC)c1nnnn1C1CCCCC1.Cl
InChIInChI=1S/C11H21N5.ClH/c1-3-15(4-2)11-12-13-14-16(11)10-8-6-5-7-9-10;/h10H,3-9H2,1-2H3;1H
InChIKeyAEGONJLTEDOYEP-UHFFFAOYSA-N
MW259.78 g/mol
LogP2.45
Rot. Bonds4

About 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride

1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride (PubChem CID 3031883) has the molecular formula C11H22ClN5 and a molecular weight of 259.78 g/mol. Its IUPAC name is 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride
PubChem CID3031883
Molecular FormulaC11H22ClN5
Molecular Weight259.78 g/mol
Exact Mass259.16
IUPAC Name1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride
SMILESCCN(CC)c1nnnn1C1CCCCC1.Cl
InChIInChI=1S/C11H21N5.ClH/c1-3-15(4-2)11-12-13-14-16(11)10-8-6-5-7-9-10;/h10H,3-9H2,1-2H3;1H
InChIKeyAEGONJLTEDOYEP-UHFFFAOYSA-N
XLogP2.45
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.78
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride?
The IUPAC name of 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride (CID 3031883) is 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride?
The canonical SMILES for 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride is CCN(CC)c1nnnn1C1CCCCC1.Cl.
What is the InChIKey of 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride?
The InChIKey is AEGONJLTEDOYEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5.ClH/c1-3-15(4-2)11-12-13-14-16(11)10-8-6-5-7-9-10;/h10H,3-9H2,1-2H3;1H.
What are the key properties of 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride?
1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride has a molecular weight of 259.78 g/mol, XLogP of 2.45, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N,N-diethyltetrazol-5-amine;hydrochloride is sourced from PubChem (CID 3031883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).