bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone

C17H34N4O — CID 174397328

IUPACbis(2,2,6,6-tetramethylpiperazin-1-yl)methanone
SMILESCC1(C)CNCC(C)(C)N1C(=O)N1C(C)(C)CNCC1(C)C
InChIInChI=1S/C17H34N4O/c1-14(2)9-18-10-15(3,4)20(14)13(22)21-16(5,6)11-19-12-17(21,7)8/h18-19H,9-12H2,1-8H3
InChIKeyFMMNVXPZWGIXQS-UHFFFAOYSA-N
MW310.49 g/mol
LogP2.03
Rot. Bonds

About bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone

bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone (PubChem CID 174397328) has the molecular formula C17H34N4O and a molecular weight of 310.49 g/mol. Its IUPAC name is bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone.

Molecular Properties

Compound Namebis(2,2,6,6-tetramethylpiperazin-1-yl)methanone
PubChem CID174397328
Molecular FormulaC17H34N4O
Molecular Weight310.49 g/mol
Exact Mass310.27
IUPAC Namebis(2,2,6,6-tetramethylpiperazin-1-yl)methanone
SMILESCC1(C)CNCC(C)(C)N1C(=O)N1C(C)(C)CNCC1(C)C
InChIInChI=1S/C17H34N4O/c1-14(2)9-18-10-15(3,4)20(14)13(22)21-16(5,6)11-19-12-17(21,7)8/h18-19H,9-12H2,1-8H3
InChIKeyFMMNVXPZWGIXQS-UHFFFAOYSA-N
XLogP2.03
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.49
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-methoxy-N,3-dimethylazetidine-3-carboxamide
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2,2-dimethyl-1-(3-methylpyrrolidin-3-yl)propan-1-one
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1-(3-methylazetidin-3-yl)ethenol
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1-(2,2-dimethylpiperazin-1-yl)-2-fluoro-2-methylpropan-1-one
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Frequently Asked Questions

What is the IUPAC name of bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone?
The IUPAC name of bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone (CID 174397328) is bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone.
What is the SMILES notation for bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone?
The canonical SMILES for bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone is CC1(C)CNCC(C)(C)N1C(=O)N1C(C)(C)CNCC1(C)C.
What is the InChIKey of bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone?
The InChIKey is FMMNVXPZWGIXQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N4O/c1-14(2)9-18-10-15(3,4)20(14)13(22)21-16(5,6)11-19-12-17(21,7)8/h18-19H,9-12H2,1-8H3.
What are the key properties of bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone?
bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone has a molecular weight of 310.49 g/mol, XLogP of 2.03, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone is sourced from PubChem (CID 174397328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).