N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine

C15H27N3O — CID 115255275

IUPACN-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine
SMILESCc1ccc(N(C)CC(C)(C)CN2CCNCC2)o1
InChIInChI=1S/C15H27N3O/c1-13-5-6-14(19-13)17(4)11-15(2,3)12-18-9-7-16-8-10-18/h5-6,16H,7-12H2,1-4H3
InChIKeyDARFITPOVXBAMF-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.96
Rot. Bonds5

About N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine

N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine (PubChem CID 115255275) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine
PubChem CID115255275
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC NameN-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine
SMILESCc1ccc(N(C)CC(C)(C)CN2CCNCC2)o1
InChIInChI=1S/C15H27N3O/c1-13-5-6-14(19-13)17(4)11-15(2,3)12-18-9-7-16-8-10-18/h5-6,16H,7-12H2,1-4H3
InChIKeyDARFITPOVXBAMF-UHFFFAOYSA-N
XLogP1.96
TPSA31.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine
CID 115229932
N,2,2-trimethyl-N-(5-methylfuran-2-yl)butane-1,4-diamine
CID 115204362
N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N-methylpyridin-2-amine
CID 115255272
N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]-2-piperazin-1-ylpropan-1-amine
CID 80551355
1-(2,2-dimethylpentyl)piperazine
CID 83530331
1-(5-methylfuran-2-yl)-2-piperazin-1-ylethanol
CID 3494816
1-(2,2,4,4-tetramethylhexyl)piperazine
CID 134351462
1-[2-methyl-3-(5-methylfuran-2-yl)propyl]piperazine
CID 116931937
N,N,2-trimethyl-1-piperazin-1-ylpropan-2-amine
CID 50852334
1-[3-(2,5-dimethylphenyl)-2,2-dimethylpropyl]piperazine
CID 82302000
1-[3-(5-methylfuran-2-yl)propyl]piperazine
CID 82161568
2-methyl-1-(5-methylfuran-2-yl)-2-piperazin-1-ylpropan-1-one
CID 116924134

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine?
The IUPAC name of N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine (CID 115255275) is N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine.
What is the SMILES notation for N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine?
The canonical SMILES for N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine is Cc1ccc(N(C)CC(C)(C)CN2CCNCC2)o1.
What is the InChIKey of N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine?
The InChIKey is DARFITPOVXBAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-13-5-6-14(19-13)17(4)11-15(2,3)12-18-9-7-16-8-10-18/h5-6,16H,7-12H2,1-4H3.
What are the key properties of N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine?
N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine has a molecular weight of 265.40 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine is sourced from PubChem (CID 115255275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).