4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine

C16H32N4O — CID 130429207

IUPAC4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine
SMILESC[C@@H]1CCC(CN2CCN(CN3CCOCC3)CC2)NC1
InChIInChI=1S/C16H32N4O/c1-15-2-3-16(17-12-15)13-18-4-6-19(7-5-18)14-20-8-10-21-11-9-20/h15-17H,2-14H2,1H3/t15-,16?/m1/s1
InChIKeyPODARJWJNVBOCB-AAFJCEBUSA-N
MW296.46 g/mol
LogP0.28
Rot. Bonds4

About 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine

4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine (PubChem CID 130429207) has the molecular formula C16H32N4O and a molecular weight of 296.46 g/mol. Its IUPAC name is 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine
PubChem CID130429207
Molecular FormulaC16H32N4O
Molecular Weight296.46 g/mol
Exact Mass296.26
IUPAC Name4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine
SMILESC[C@@H]1CCC(CN2CCN(CN3CCOCC3)CC2)NC1
InChIInChI=1S/C16H32N4O/c1-15-2-3-16(17-12-15)13-18-4-6-19(7-5-18)14-20-8-10-21-11-9-20/h15-17H,2-14H2,1H3/t15-,16?/m1/s1
InChIKeyPODARJWJNVBOCB-AAFJCEBUSA-N
XLogP0.28
TPSA30.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.46
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine?
The IUPAC name of 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine (CID 130429207) is 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine.
What is the SMILES notation for 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine?
The canonical SMILES for 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine is C[C@@H]1CCC(CN2CCN(CN3CCOCC3)CC2)NC1.
What is the InChIKey of 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine?
The InChIKey is PODARJWJNVBOCB-AAFJCEBUSA-N. The full InChI is InChI=1S/C16H32N4O/c1-15-2-3-16(17-12-15)13-18-4-6-19(7-5-18)14-20-8-10-21-11-9-20/h15-17H,2-14H2,1H3/t15-,16?/m1/s1.
What are the key properties of 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine?
4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine has a molecular weight of 296.46 g/mol, XLogP of 0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-[[(5R)-5-methylpiperidin-2-yl]methyl]piperazin-1-yl]methyl]morpholine is sourced from PubChem (CID 130429207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).