1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine

C16H32N2 — CID 64934807

IUPAC1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
SMILESCC(C)CC1CN(CC2CCC2)C(C(C)C)CN1
InChIInChI=1S/C16H32N2/c1-12(2)8-15-11-18(10-14-6-5-7-14)16(9-17-15)13(3)4/h12-17H,5-11H2,1-4H3
InChIKeyOZRSMLHCMRLMCE-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.13
Rot. Bonds5

About 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine

1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine (PubChem CID 64934807) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
PubChem CID64934807
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
SMILESCC(C)CC1CN(CC2CCC2)C(C(C)C)CN1
InChIInChI=1S/C16H32N2/c1-12(2)8-15-11-18(10-14-6-5-7-14)16(9-17-15)13(3)4/h12-17H,5-11H2,1-4H3
InChIKeyOZRSMLHCMRLMCE-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclobutylmethyl)-5-methyl-2-propan-2-ylpiperazine
CID 64937495
2-butan-2-yl-5-(2-methylpropyl)-1-(oxan-4-ylmethyl)piperazine
CID 64848740
5-(2-methylpropyl)-2-propan-2-yl-1-(2,2,2-trifluoroethyl)piperazine
CID 64848157
2-butan-2-yl-1-(cyclopentylmethyl)-5-ethylpiperazine
CID 64843292
5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine
CID 64842219
1-(oxan-4-ylmethyl)-2-propan-2-yl-5-propylpiperazine
CID 64838582
N,N-dimethyl-3-[5-(2-methylpropyl)-2-propan-2-ylpiperazin-1-yl]propan-1-amine
CID 64933854
2,5-bis(2-methylpropyl)-1-(oxan-4-ylmethyl)piperazine
CID 64848743
1-(2-methylcyclopentyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64941388
1-(cyclopentylmethyl)-2-(2-methylpropyl)-5-propylpiperazine
CID 64840737
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 115943612
1-(1-cyclopropylbutan-2-yl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64941639

Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine?
The IUPAC name of 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine (CID 64934807) is 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine?
The canonical SMILES for 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine is CC(C)CC1CN(CC2CCC2)C(C(C)C)CN1.
What is the InChIKey of 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine?
The InChIKey is OZRSMLHCMRLMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-12(2)8-15-11-18(10-14-6-5-7-14)16(9-17-15)13(3)4/h12-17H,5-11H2,1-4H3.
What are the key properties of 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine?
1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine is sourced from PubChem (CID 64934807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).