N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine

C11H22F2N2O — CID 159141091

IUPACN-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CN(CC(F)F)CCO1
InChIInChI=1S/C11H22F2N2O/c1-11(2,3)14-6-9-7-15(4-5-16-9)8-10(12)13/h9-10,14H,4-8H2,1-3H3
InChIKeyZIPYHWCRAGONOB-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.34
Rot. Bonds4

About N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine

N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 159141091) has the molecular formula C11H22F2N2O and a molecular weight of 236.31 g/mol. Its IUPAC name is N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID159141091
Molecular FormulaC11H22F2N2O
Molecular Weight236.31 g/mol
Exact Mass236.17
IUPAC NameN-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CN(CC(F)F)CCO1
InChIInChI=1S/C11H22F2N2O/c1-11(2,3)14-6-9-7-15(4-5-16-9)8-10(12)13/h9-10,14H,4-8H2,1-3H3
InChIKeyZIPYHWCRAGONOB-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine (CID 159141091) is N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1CN(CC(F)F)CCO1.
What is the InChIKey of N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is ZIPYHWCRAGONOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F2N2O/c1-11(2,3)14-6-9-7-15(4-5-16-9)8-10(12)13/h9-10,14H,4-8H2,1-3H3.
What are the key properties of N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine?
N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 236.31 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2,2-difluoroethyl)morpholin-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 159141091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).