2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine

C16H30N2O — CID 103141435

IUPAC2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
SMILESCCC1(C)CN(CC2CCC(C)O2)C(C2CC2)CN1
InChIInChI=1S/C16H30N2O/c1-4-16(3)11-18(10-14-8-5-12(2)19-14)15(9-17-16)13-6-7-13/h12-15,17H,4-11H2,1-3H3
InChIKeyGSMDAZAENOQUHH-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.41
Rot. Bonds4

About 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine

2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine (PubChem CID 103141435) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine.

Molecular Properties

Compound Name2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
PubChem CID103141435
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
SMILESCCC1(C)CN(CC2CCC(C)O2)C(C2CC2)CN1
InChIInChI=1S/C16H30N2O/c1-4-16(3)11-18(10-14-8-5-12(2)19-14)15(9-17-16)13-6-7-13/h12-15,17H,4-11H2,1-3H3
InChIKeyGSMDAZAENOQUHH-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(oxolan-2-ylmethyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propan-1-amine
CID 62556592
N-[[5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 65531694
N-[[5-[[4-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 65532482
N-(oxolan-2-ylmethyl)-2-[4-(trifluoromethyl)piperidin-1-yl]propan-1-amine
CID 65532881
(2R)-3-methyl-1-N-[[(2R)-oxolan-2-yl]methyl]butane-1,2-diamine
CID 89339942
1-(2-methylpropyl)-N-(oxolan-2-ylmethyl)piperidin-4-amine
CID 103775787
2-methyl-N-[2-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]ethyl]propan-2-amine
CID 117684668
4-[2-[1-(1-Methylpyrrolidin-2-yl)ethoxy]ethyl]piperidine
CID 117739493
1,2-dimethylpiperidine;ethane;N-methyl-1-(oxolan-2-yl)methanamine;1,3,5-trimethylpiperidine
CID 143283923
4-fluoro-1-methyl-2-[(1S)-1-propan-2-yloxyethyl]pyrrolidine;(2S)-2-methyl-1-propan-2-ylpiperazine
CID 168910239
1-N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-1-N,3-dimethyl-3-N-(oxolan-2-ylmethyl)butane-1,3-diamine
CID 169636552
1-[[(2S,3S,4R,5S)-3,4,5-trimethyloxolan-2-yl]methyl]piperazine
CID 173746758

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The IUPAC name of 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine (CID 103141435) is 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine.
What is the SMILES notation for 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The canonical SMILES for 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine is CCC1(C)CN(CC2CCC(C)O2)C(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The InChIKey is GSMDAZAENOQUHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-4-16(3)11-18(10-14-8-5-12(2)19-14)15(9-17-16)13-6-7-13/h12-15,17H,4-11H2,1-3H3.
What are the key properties of 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine has a molecular weight of 266.43 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine is sourced from PubChem (CID 103141435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).