2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole

C15H27N3O — CID 106376843

IUPAC2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole
SMILESCCC1(CC)CN(Cc2nc(C)c(C)o2)C(C)CN1
InChIInChI=1S/C15H27N3O/c1-6-15(7-2)10-18(11(3)8-16-15)9-14-17-12(4)13(5)19-14/h11,16H,6-10H2,1-5H3
InChIKeyDUAMIQSRCHMCGT-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.64
Rot. Bonds4

About 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole

2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole (PubChem CID 106376843) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole.

Molecular Properties

Compound Name2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole
PubChem CID106376843
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole
SMILESCCC1(CC)CN(Cc2nc(C)c(C)o2)C(C)CN1
InChIInChI=1S/C15H27N3O/c1-6-15(7-2)10-18(11(3)8-16-15)9-14-17-12(4)13(5)19-14/h11,16H,6-10H2,1-5H3
InChIKeyDUAMIQSRCHMCGT-UHFFFAOYSA-N
XLogP2.64
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-1,2-oxazole
CID 81173577
5,5-diethyl-2-methyl-1-[(3-methylphenyl)methyl]piperazine
CID 64860604
1-benzyl-5,5-diethyl-2-methylpiperazine
CID 64862341
1-[(3,4-dimethylphenyl)methyl]-5,5-diethyl-2-methylpiperazine
CID 64861187
5,5-diethyl-2-methyl-1-(pyridin-3-ylmethyl)piperazine
CID 64860612
5-methyl-2-[(2,5,5-trimethylpiperazin-1-yl)methyl]-1,3-oxazole
CID 106376719
2-[(5,5-diethyl-2-propan-2-ylpiperazin-1-yl)methyl]-5-methyl-1,3-oxazole
CID 106376737
5,5-diethyl-2-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]piperazine
CID 103016611
1-[(2,4-difluorophenyl)methyl]-5,5-diethyl-2-methylpiperazine
CID 64859837
5,5-diethyl-2-methyl-1-(2-methylcyclopropyl)piperazine
CID 64948522
5,5-diethyl-2-methyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64860416
2-[(5-tert-butyl-2-propan-2-ylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole
CID 106376809

Frequently Asked Questions

What is the IUPAC name of 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole?
The IUPAC name of 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole (CID 106376843) is 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole.
What is the SMILES notation for 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole?
The canonical SMILES for 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole is CCC1(CC)CN(Cc2nc(C)c(C)o2)C(C)CN1.
What is the InChIKey of 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole?
The InChIKey is DUAMIQSRCHMCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-6-15(7-2)10-18(11(3)8-16-15)9-14-17-12(4)13(5)19-14/h11,16H,6-10H2,1-5H3.
What are the key properties of 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole?
2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole has a molecular weight of 265.40 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4,5-dimethyl-1,3-oxazole is sourced from PubChem (CID 106376843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).