1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine

C15H28N10 — CID 162262113

IUPAC1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine
SMILESCN1CCC(n2cnnn2)CC1.Cc1nnnn1C1CCN(C)CC1
InChIInChI=1S/C8H15N5.C7H13N5/c1-7-9-10-11-13(7)8-3-5-12(2)6-4-8;1-11-4-2-7(3-5-11)12-6-8-9-10-12/h8H,3-6H2,1-2H3;6-7H,2-5H2,1H3
InChIKeyZZJWIDQXJVMFOB-UHFFFAOYSA-N
MW348.46 g/mol
LogP0.19
Rot. Bonds2

About 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine

1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine (PubChem CID 162262113) has the molecular formula C15H28N10 and a molecular weight of 348.46 g/mol. Its IUPAC name is 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine.

Molecular Properties

Compound Name1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine
PubChem CID162262113
Molecular FormulaC15H28N10
Molecular Weight348.46 g/mol
Exact Mass348.25
IUPAC Name1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine
SMILESCN1CCC(n2cnnn2)CC1.Cc1nnnn1C1CCN(C)CC1
InChIInChI=1S/C8H15N5.C7H13N5/c1-7-9-10-11-13(7)8-3-5-12(2)6-4-8;1-11-4-2-7(3-5-11)12-6-8-9-10-12/h8H,3-6H2,1-2H3;6-7H,2-5H2,1H3
InChIKeyZZJWIDQXJVMFOB-UHFFFAOYSA-N
XLogP0.19
TPSA93.68 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.46
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Related Compounds

4-(1-cyclopropyltetrazol-5-yl)-1-methylpiperidine
CID 118303256
4-(3,4-dimethylpyrazol-1-yl)-1-methylpiperidine;ethane
CID 177246443
1-[4-(tetrazol-1-yl)cyclohexyl]ethanone
CID 58356128
4-(3-ethylpyrazol-1-yl)-1-methylpiperidine
CID 170573689
[4-(tetrazol-1-yl)cyclohexyl]methanol
CID 123336370
1-[(1R,2R)-2-bromocyclohexyl]-5-methyltetrazole
CID 102075444
1-(3-chlorocyclohexyl)tetrazole
CID 23454027
ethyl 1-(1-methylpiperidin-4-yl)triazole-4-carboxylate
CID 58493124
5-methyl-2-(1-methylpiperidin-4-yl)indazole
CID 164997785
1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperazine
CID 858492
1-[1-(1-cyclohexyltetrazol-5-yl)propyl]-4-methylpiperazine
CID 3208531
1-[1-(1-cyclopentyltetrazol-5-yl)propyl]-4-methylpiperazine;hydrochloride
CID 171668130

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine?
The IUPAC name of 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine (CID 162262113) is 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine.
What is the SMILES notation for 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine?
The canonical SMILES for 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine is CN1CCC(n2cnnn2)CC1.Cc1nnnn1C1CCN(C)CC1.
What is the InChIKey of 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine?
The InChIKey is ZZJWIDQXJVMFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5.C7H13N5/c1-7-9-10-11-13(7)8-3-5-12(2)6-4-8;1-11-4-2-7(3-5-11)12-6-8-9-10-12/h8H,3-6H2,1-2H3;6-7H,2-5H2,1H3.
What are the key properties of 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine?
1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine has a molecular weight of 348.46 g/mol, XLogP of 0.19, 2 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(5-methyltetrazol-1-yl)piperidine;1-methyl-4-(tetrazol-1-yl)piperidine is sourced from PubChem (CID 162262113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).