1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine

C15H26N2O — CID 64935794

IUPAC1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C)(C)CN1C(C)c1ccco1
InChIInChI=1S/C15H26N2O/c1-11(2)13-9-16-15(4,5)10-17(13)12(3)14-7-6-8-18-14/h6-8,11-13,16H,9-10H2,1-5H3
InChIKeyZNMKFZPVVNGJAB-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.05
Rot. Bonds3

About 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine

1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine (PubChem CID 64935794) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine
PubChem CID64935794
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C)(C)CN1C(C)c1ccco1
InChIInChI=1S/C15H26N2O/c1-11(2)13-9-16-15(4,5)10-17(13)12(3)14-7-6-8-18-14/h6-8,11-13,16H,9-10H2,1-5H3
InChIKeyZNMKFZPVVNGJAB-UHFFFAOYSA-N
XLogP3.05
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5,5-dimethyl-1-[1-(4-methylphenyl)ethyl]-2-propan-2-ylpiperazine
CID 64947844
(2S)-1,5,5-trimethyl-2-propan-2-ylpiperazine
CID 94982663
5-cyclopropyl-1-[1-(furan-2-yl)propan-2-yl]-5-methyl-2-propan-2-ylpiperazine
CID 64945850
1-[1-(4-chlorophenyl)ethyl]-5-ethyl-5-methyl-2-propan-2-ylpiperazine
CID 64946846
5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine
CID 64945583
1-(4-methoxyphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64932532
1-[1-(furan-2-yl)ethyl]-3,7-dimethyl-1,5-diazocane
CID 54973303
4-[(5,5-dimethyl-2-propan-2-ylpiperazin-1-yl)methyl]-2-methylpyrimidine
CID 64945782
1-(3-chloro-2-fluorophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64935490
[(2S)-1-[(1R)-1-(furan-2-yl)ethyl]pyrrolidin-2-yl]methanamine
CID 129427489
4-[2-(furan-2-yl)ethyl]-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64946817
2-ethyl-5,5-dimethyl-1-(1-thiophen-2-ylethyl)piperazine
CID 64934167

Frequently Asked Questions

What is the IUPAC name of 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine?
The IUPAC name of 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine (CID 64935794) is 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine?
The canonical SMILES for 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine is CC(C)C1CNC(C)(C)CN1C(C)c1ccco1.
What is the InChIKey of 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine?
The InChIKey is ZNMKFZPVVNGJAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-11(2)13-9-16-15(4,5)10-17(13)12(3)14-7-6-8-18-14/h6-8,11-13,16H,9-10H2,1-5H3.
What are the key properties of 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine?
1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine has a molecular weight of 250.39 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(furan-2-yl)ethyl]-5,5-dimethyl-2-propan-2-ylpiperazine is sourced from PubChem (CID 64935794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).