4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine

C20H32N2O — CID 60503695

IUPAC4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine
SMILESCC(C)c1ccc(CN2CCC(CN3CCOCC3)CC2)cc1
InChIInChI=1S/C20H32N2O/c1-17(2)20-5-3-18(4-6-20)15-21-9-7-19(8-10-21)16-22-11-13-23-14-12-22/h3-6,17,19H,7-16H2,1-2H3
InChIKeyOZRVERIGRAHVIX-UHFFFAOYSA-N
MW316.49 g/mol
LogP3.35
Rot. Bonds5

About 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine

4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine (PubChem CID 60503695) has the molecular formula C20H32N2O and a molecular weight of 316.49 g/mol. Its IUPAC name is 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine
PubChem CID60503695
Molecular FormulaC20H32N2O
Molecular Weight316.49 g/mol
Exact Mass316.25
IUPAC Name4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine
SMILESCC(C)c1ccc(CN2CCC(CN3CCOCC3)CC2)cc1
InChIInChI=1S/C20H32N2O/c1-17(2)20-5-3-18(4-6-20)15-21-9-7-19(8-10-21)16-22-11-13-23-14-12-22/h3-6,17,19H,7-16H2,1-2H3
InChIKeyOZRVERIGRAHVIX-UHFFFAOYSA-N
XLogP3.35
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.49
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine with MolForge

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Related Compounds

N-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-4-amine
CID 60820296
1-[(4-propan-2-ylphenyl)methyl]azetidine
CID 58279197
4-[[1-[(3-bromophenyl)methyl]piperidin-4-yl]methyl]morpholine
CID 60503694
4-[[1-[(5-ethyl-2-pyridinyl)methyl]piperidin-4-yl]methyl]morpholine
CID 77091868
2-[4-(morpholin-4-ylmethyl)phenyl]propanoic acid
CID 105345603
N-[[1-[(4-propan-2-ylphenyl)methyl]pyrrolidin-3-yl]methyl]propan-2-amine
CID 62512469
4-[3-(4-propan-2-ylphenyl)propyl]morpholine
CID 146185786
4-[(2-chloro-4-propan-2-ylphenyl)methyl]morpholine;ethane
CID 143579646
4-[[4-[(1S)-1-morpholin-4-ylethyl]piperidin-1-yl]methyl]phenol
CID 95894012
4-(morpholin-4-ylmethyl)-N-propan-2-ylaniline
CID 28716282
4-[(1-ethylpiperidin-4-yl)methyl]morpholine;propane
CID 176563536
ethane;4-[[3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]phenyl]methyl]morpholine
CID 142888836

Frequently Asked Questions

What is the IUPAC name of 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine?
The IUPAC name of 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine (CID 60503695) is 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine.
What is the SMILES notation for 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine?
The canonical SMILES for 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine is CC(C)c1ccc(CN2CCC(CN3CCOCC3)CC2)cc1.
What is the InChIKey of 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine?
The InChIKey is OZRVERIGRAHVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O/c1-17(2)20-5-3-18(4-6-20)15-21-9-7-19(8-10-21)16-22-11-13-23-14-12-22/h3-6,17,19H,7-16H2,1-2H3.
What are the key properties of 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine?
4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine has a molecular weight of 316.49 g/mol, XLogP of 3.35, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-[(4-propan-2-ylphenyl)methyl]piperidin-4-yl]methyl]morpholine is sourced from PubChem (CID 60503695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).