2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine

C15H30N2O — CID 165136775

IUPAC2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine
SMILESCC(C)OC1CCC(CN2CCNCC2C)CC1
InChIInChI=1S/C15H30N2O/c1-12(2)18-15-6-4-14(5-7-15)11-17-9-8-16-10-13(17)3/h12-16H,4-11H2,1-3H3
InChIKeyZSLBTYOVRPNTOA-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.26
Rot. Bonds4

About 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine

2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine (PubChem CID 165136775) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine.

Molecular Properties

Compound Name2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine
PubChem CID165136775
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine
SMILESCC(C)OC1CCC(CN2CCNCC2C)CC1
InChIInChI=1S/C15H30N2O/c1-12(2)18-15-6-4-14(5-7-15)11-17-9-8-16-10-13(17)3/h12-16H,4-11H2,1-3H3
InChIKeyZSLBTYOVRPNTOA-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-(piperidin-4-ylmethyl)piperazine;propane
CID 156712071
tert-butyl formate;1-(cyclopropylmethyl)-2-methylpiperazine
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(2R)-1-(cyclopropylmethyl)-2-methylpiperazine;2,2,2-trifluoroacetic acid
CID 172731821
2-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]piperazine
CID 64931690
(2R)-2-methyl-1-(oxan-3-ylmethyl)piperazine;hydrochloride
CID 130678897
2-methyl-1-(2-methylpropyl)piperazine
CID 53405905
(2R)-1-(1-cyclopropylpropan-2-yl)-2-methylpiperazine;hydrochloride
CID 130908546
[5-[(2-methylpiperazin-1-yl)methyl]piperidin-3-yl]methanamine
CID 165449050
2-methyl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008832
methyl 2-methyl-3-[(2R)-2-methylpiperazin-1-yl]propanoate
CID 82760949
ethane;(2S)-1-ethyl-2-methylpiperazine
CID 154651366
(2R)-2-methyl-1-[(1-methylsulfonylpiperidin-3-yl)methyl]piperazine
CID 82713447

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine?
The IUPAC name of 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine (CID 165136775) is 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine.
What is the SMILES notation for 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine?
The canonical SMILES for 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine is CC(C)OC1CCC(CN2CCNCC2C)CC1.
What is the InChIKey of 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine?
The InChIKey is ZSLBTYOVRPNTOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12(2)18-15-6-4-14(5-7-15)11-17-9-8-16-10-13(17)3/h12-16H,4-11H2,1-3H3.
What are the key properties of 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine?
2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine has a molecular weight of 254.42 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(4-propan-2-yloxycyclohexyl)methyl]piperazine is sourced from PubChem (CID 165136775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).