1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine

C10H20F2N2 — CID 64831726

IUPAC1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine
SMILESCC(C)C1CN(CC(F)F)C(C)CN1
InChIInChI=1S/C10H20F2N2/c1-7(2)9-5-14(6-10(11)12)8(3)4-13-9/h7-10,13H,4-6H2,1-3H3
InChIKeyUZACBEYLRPAGJQ-UHFFFAOYSA-N
MW206.28 g/mol
LogP1.57
Rot. Bonds3

About 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine

1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine (PubChem CID 64831726) has the molecular formula C10H20F2N2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine
PubChem CID64831726
Molecular FormulaC10H20F2N2
Molecular Weight206.28 g/mol
Exact Mass206.16
IUPAC Name1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine
SMILESCC(C)C1CN(CC(F)F)C(C)CN1
InChIInChI=1S/C10H20F2N2/c1-7(2)9-5-14(6-10(11)12)8(3)4-13-9/h7-10,13H,4-6H2,1-3H3
InChIKeyUZACBEYLRPAGJQ-UHFFFAOYSA-N
XLogP1.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-(4-methylpentyl)-5-propan-2-ylpiperazine
CID 64937614
1-heptyl-2-methyl-5-propan-2-ylpiperazine
CID 64833309
2-methyl-5-propan-2-yl-1-prop-2-ynylpiperazine
CID 64937731
2-methyl-5-propan-2-yl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine
CID 79350021
1-[3-(cyclopropylmethoxy)propyl]-2-methyl-5-propan-2-ylpiperazine
CID 114097844
2-methyl-5-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008768
1-hex-5-ynyl-2-methyl-5-propan-2-ylpiperazine
CID 106211794
2-methyl-1-(2-phenylethyl)-5-propan-2-ylpiperazine
CID 64833712
1-[(2,4-difluorophenyl)methyl]-2-methyl-5-propan-2-ylpiperazine
CID 64833514
2-methyl-5-propan-2-yl-1-(2-prop-2-ynylsulfanylethyl)piperazine
CID 106432746
3-butan-2-yl-1-(2,2-difluoroethyl)-7-methyl-1,4-diazepane
CID 64870751
2-methyl-5-propan-2-yl-1-[[4-(trifluoromethyl)phenyl]methyl]piperazine
CID 64832908

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine?
The IUPAC name of 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine (CID 64831726) is 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine.
What is the SMILES notation for 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine?
The canonical SMILES for 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine is CC(C)C1CN(CC(F)F)C(C)CN1.
What is the InChIKey of 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine?
The InChIKey is UZACBEYLRPAGJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F2N2/c1-7(2)9-5-14(6-10(11)12)8(3)4-13-9/h7-10,13H,4-6H2,1-3H3.
What are the key properties of 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine?
1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine has a molecular weight of 206.28 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)-2-methyl-5-propan-2-ylpiperazine is sourced from PubChem (CID 64831726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).