2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine

C20H32N2O2 — CID 75472080

IUPAC2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine
SMILESCC1CC(NC(Cc2ccccc2)CN2CCOCC2)CC(C)O1
InChIInChI=1S/C20H32N2O2/c1-16-12-19(13-17(2)24-16)21-20(14-18-6-4-3-5-7-18)15-22-8-10-23-11-9-22/h3-7,16-17,19-21H,8-15H2,1-2H3
InChIKeySSKVXQQWAMSKOB-UHFFFAOYSA-N
MW332.49 g/mol
LogP2.48
Rot. Bonds6

About 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine

2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine (PubChem CID 75472080) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine
PubChem CID75472080
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC Name2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine
SMILESCC1CC(NC(Cc2ccccc2)CN2CCOCC2)CC(C)O1
InChIInChI=1S/C20H32N2O2/c1-16-12-19(13-17(2)24-16)21-20(14-18-6-4-3-5-7-18)15-22-8-10-23-11-9-22/h3-7,16-17,19-21H,8-15H2,1-2H3
InChIKeySSKVXQQWAMSKOB-UHFFFAOYSA-N
XLogP2.48
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine?
The IUPAC name of 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine (CID 75472080) is 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine.
What is the SMILES notation for 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine?
The canonical SMILES for 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine is CC1CC(NC(Cc2ccccc2)CN2CCOCC2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine?
The InChIKey is SSKVXQQWAMSKOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-16-12-19(13-17(2)24-16)21-20(14-18-6-4-3-5-7-18)15-22-8-10-23-11-9-22/h3-7,16-17,19-21H,8-15H2,1-2H3.
What are the key properties of 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine?
2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine has a molecular weight of 332.49 g/mol, XLogP of 2.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(1-morpholin-4-yl-3-phenylpropan-2-yl)oxan-4-amine is sourced from PubChem (CID 75472080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).