4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine

C17H34N2O — CID 129028216

IUPAC4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine
SMILESCC(C)(C)N1CCCC(CC(C)(C)N2CCOCC2)C1
InChIInChI=1S/C17H34N2O/c1-16(2,3)19-8-6-7-15(14-19)13-17(4,5)18-9-11-20-12-10-18/h15H,6-14H2,1-5H3
InChIKeyVRDHIHXVWZFTGC-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.00
Rot. Bonds3

About 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine

4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine (PubChem CID 129028216) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine.

Molecular Properties

Compound Name4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine
PubChem CID129028216
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine
SMILESCC(C)(C)N1CCCC(CC(C)(C)N2CCOCC2)C1
InChIInChI=1S/C17H34N2O/c1-16(2,3)19-8-6-7-15(14-19)13-17(4,5)18-9-11-20-12-10-18/h15H,6-14H2,1-5H3
InChIKeyVRDHIHXVWZFTGC-UHFFFAOYSA-N
XLogP3.00
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-Methyl-7-morpholin-4-ylheptyl)morpholine
CID 15370618
4-(4,4-Dimethyl-7-morpholin-4-ylheptyl)morpholine
CID 11098562
4-(2,5-Dimethyl-6-morpholin-4-ylhexyl)morpholine
CID 15370617
4-(2,7-Dimethyl-8-morpholin-4-yloctyl)morpholine
CID 15370619
4-(2-Methyl-9-morpholin-4-ylnonyl)morpholine
CID 15370620
4-(3,4-Dimethyl-6-morpholin-4-ylhexyl)morpholine
CID 15370627
1-Tert-butyl-4-fluoro-4-[[4-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]piperidin-1-yl]methyl]piperidine
CID 172129061
1-[(1-Tert-butylpiperidin-4-yl)methyl]-4-fluoro-4-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]piperidine
CID 172129175
4-[(1-Tert-butylpiperidin-4-yl)methyl]-4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
CID 172129305
4-[[1-[(1-Tert-butylpiperidin-4-yl)methyl]piperidin-4-yl]methyl]-4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
CID 172129401
4-Fluoro-1-(2-methoxyethyl)-4-[(1-methylpiperidin-4-yl)methyl]piperidine
CID 172252012
4-(2-Methyldodecyl)morpholine
CID 11076481

Frequently Asked Questions

What is the IUPAC name of 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine?
The IUPAC name of 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine (CID 129028216) is 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine.
What is the SMILES notation for 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine?
The canonical SMILES for 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine is CC(C)(C)N1CCCC(CC(C)(C)N2CCOCC2)C1.
What is the InChIKey of 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine?
The InChIKey is VRDHIHXVWZFTGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-16(2,3)19-8-6-7-15(14-19)13-17(4,5)18-9-11-20-12-10-18/h15H,6-14H2,1-5H3.
What are the key properties of 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine?
4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine has a molecular weight of 282.47 g/mol, XLogP of 3.00, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(1-tert-butylpiperidin-3-yl)-2-methylpropan-2-yl]morpholine is sourced from PubChem (CID 129028216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).