5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine

C19H26N2 — CID 64945583

IUPAC5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C)(C)CN1c1ccc2ccccc2c1
InChIInChI=1S/C19H26N2/c1-14(2)18-12-20-19(3,4)13-21(18)17-10-9-15-7-5-6-8-16(15)11-17/h5-11,14,18,20H,12-13H2,1-4H3
InChIKeyNOBXLCQMKCQXPQ-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.05
Rot. Bonds2

About 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine

5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine (PubChem CID 64945583) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine
PubChem CID64945583
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C)(C)CN1c1ccc2ccccc2c1
InChIInChI=1S/C19H26N2/c1-14(2)18-12-20-19(3,4)13-21(18)17-10-9-15-7-5-6-8-16(15)11-17/h5-11,14,18,20H,12-13H2,1-4H3
InChIKeyNOBXLCQMKCQXPQ-UHFFFAOYSA-N
XLogP4.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dichlorophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64935824
1-(4-methoxyphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64932532
1-(4-bromo-3-methylphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64935073
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64930805
1-(4-methoxy-3-methylphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64946280
1-(4-chloro-3-methoxyphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 107623424
5,5-dimethyl-2-propan-2-yl-1-[6-(trifluoromethyl)-3-pyridinyl]piperazine
CID 82794702
3,3-dimethyl-1-naphthalen-2-yl-1,4-diazepane
CID 64948746
1-(2,4-dimethylphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64930665
5,5-dimethyl-2-propan-2-yl-1-(2,4,5-trichlorophenyl)piperazine
CID 64934504
1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64946247
1-(3-chloro-2-fluorophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64935490

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine?
The IUPAC name of 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine (CID 64945583) is 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine.
What is the SMILES notation for 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine?
The canonical SMILES for 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine is CC(C)C1CNC(C)(C)CN1c1ccc2ccccc2c1.
What is the InChIKey of 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine?
The InChIKey is NOBXLCQMKCQXPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-14(2)18-12-20-19(3,4)13-21(18)17-10-9-15-7-5-6-8-16(15)11-17/h5-11,14,18,20H,12-13H2,1-4H3.
What are the key properties of 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine?
5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine has a molecular weight of 282.43 g/mol, XLogP of 4.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine is sourced from PubChem (CID 64945583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).