N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine

C17H28N2O2 — CID 102745973

IUPACN-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine
SMILESCC1(C)CN(Cc2occc2CNC2CC2)CC(C)(C)O1
InChIInChI=1S/C17H28N2O2/c1-16(2)11-19(12-17(3,4)21-16)10-15-13(7-8-20-15)9-18-14-5-6-14/h7-8,14,18H,5-6,9-12H2,1-4H3
InChIKeyWUAJMHLKQNMOHA-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.92
Rot. Bonds5

About N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine

N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine (PubChem CID 102745973) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine
PubChem CID102745973
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine
SMILESCC1(C)CN(Cc2occc2CNC2CC2)CC(C)(C)O1
InChIInChI=1S/C17H28N2O2/c1-16(2)11-19(12-17(3,4)21-16)10-15-13(7-8-20-15)9-18-14-5-6-14/h7-8,14,18H,5-6,9-12H2,1-4H3
InChIKeyWUAJMHLKQNMOHA-UHFFFAOYSA-N
XLogP2.92
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine (CID 102745973) is N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine is CC1(C)CN(Cc2occc2CNC2CC2)CC(C)(C)O1.
What is the InChIKey of N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine?
The InChIKey is WUAJMHLKQNMOHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-16(2)11-19(12-17(3,4)21-16)10-15-13(7-8-20-15)9-18-14-5-6-14/h7-8,14,18H,5-6,9-12H2,1-4H3.
What are the key properties of N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine?
N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine has a molecular weight of 292.42 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(2,2,6,6-tetramethylmorpholin-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 102745973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).