2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine

C15H28N6 — CID 107056008

IUPAC2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine
SMILESCCC(C)C1CNC(C)(C2CC2)CN1Cc1nnn(C)n1
InChIInChI=1S/C15H28N6/c1-5-11(2)13-8-16-15(3,12-6-7-12)10-21(13)9-14-17-19-20(4)18-14/h11-13,16H,5-10H2,1-4H3
InChIKeyLQGUTTZRCFSPNK-UHFFFAOYSA-N
MW292.43 g/mol
LogP1.20
Rot. Bonds5

About 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine

2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine (PubChem CID 107056008) has the molecular formula C15H28N6 and a molecular weight of 292.43 g/mol. Its IUPAC name is 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine.

Molecular Properties

Compound Name2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine
PubChem CID107056008
Molecular FormulaC15H28N6
Molecular Weight292.43 g/mol
Exact Mass292.24
IUPAC Name2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine
SMILESCCC(C)C1CNC(C)(C2CC2)CN1Cc1nnn(C)n1
InChIInChI=1S/C15H28N6/c1-5-11(2)13-8-16-15(3,12-6-7-12)10-21(13)9-14-17-19-20(4)18-14/h11-13,16H,5-10H2,1-4H3
InChIKeyLQGUTTZRCFSPNK-UHFFFAOYSA-N
XLogP1.20
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-butan-2-yl-5-cyclopropyl-5-methyl-1-propylpiperazine
CID 64876547
2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
CID 64877873
2-butan-2-yl-1-(3-chloro-2-methylprop-2-enyl)-5-cyclopropyl-5-methylpiperazine
CID 106440507
3-ethyl-3,7-dimethyl-1-[(2-methyltetrazol-5-yl)methyl]-1,4-diazepane
CID 107056288
5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine
CID 107056053
5-cyclopropyl-2-ethyl-5-methyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64875953
5-cyclopropyl-5-methyl-1-[(3-methylphenyl)methyl]-2-propan-2-ylpiperazine
CID 64876545
5-cyclopropyl-5-methyl-2-(2-methylpropyl)-1-[(1-methyltriazol-4-yl)methyl]piperazine
CID 107056009
5-cyclopropyl-5-methyl-1-[(6-methyl-3-pyridinyl)methyl]-2-propan-2-ylpiperazine
CID 64941949
2-[2-(5-cyclopropyl-5-methyl-2-propan-2-ylpiperazin-1-yl)ethyl]-1,3-thiazole
CID 64940605
2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine
CID 64876136
5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine
CID 64934750

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine?
The IUPAC name of 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine (CID 107056008) is 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine.
What is the SMILES notation for 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine?
The canonical SMILES for 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine is CCC(C)C1CNC(C)(C2CC2)CN1Cc1nnn(C)n1.
What is the InChIKey of 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine?
The InChIKey is LQGUTTZRCFSPNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N6/c1-5-11(2)13-8-16-15(3,12-6-7-12)10-21(13)9-14-17-19-20(4)18-14/h11-13,16H,5-10H2,1-4H3.
What are the key properties of 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine?
2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine has a molecular weight of 292.43 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine is sourced from PubChem (CID 107056008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).