N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine

C15H28N2O — CID 80999244

IUPACN-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine
SMILESCC1CN(C2CCC2CNC2CC2)CC(C)(C)O1
InChIInChI=1S/C15H28N2O/c1-11-9-17(10-15(2,3)18-11)14-7-4-12(14)8-16-13-5-6-13/h11-14,16H,4-10H2,1-3H3
InChIKeyYRVPZZYFANJZHA-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.02
Rot. Bonds4

About N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine

N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine (PubChem CID 80999244) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine
PubChem CID80999244
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine
SMILESCC1CN(C2CCC2CNC2CC2)CC(C)(C)O1
InChIInChI=1S/C15H28N2O/c1-11-9-17(10-15(2,3)18-11)14-7-4-12(14)8-16-13-5-6-13/h11-14,16H,4-10H2,1-3H3
InChIKeyYRVPZZYFANJZHA-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine (CID 80999244) is N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine is CC1CN(C2CCC2CNC2CC2)CC(C)(C)O1.
What is the InChIKey of N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine?
The InChIKey is YRVPZZYFANJZHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-11-9-17(10-15(2,3)18-11)14-7-4-12(14)8-16-13-5-6-13/h11-14,16H,4-10H2,1-3H3.
What are the key properties of N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine?
N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine has a molecular weight of 252.40 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,2,6-trimethylmorpholin-4-yl)cyclobutyl]methyl]cyclopropanamine is sourced from PubChem (CID 80999244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).