N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine

C14H28N2O — CID 169289959

IUPACN-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine
SMILESCC(C)NC1CN2CCCC2(COC(C)C)C1
InChIInChI=1S/C14H28N2O/c1-11(2)15-13-8-14(10-17-12(3)4)6-5-7-16(14)9-13/h11-13,15H,5-10H2,1-4H3
InChIKeyMAEACIPKJRIKMZ-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.02
Rot. Bonds5

About N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine

N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine (PubChem CID 169289959) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine
PubChem CID169289959
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine
SMILESCC(C)NC1CN2CCCC2(COC(C)C)C1
InChIInChI=1S/C14H28N2O/c1-11(2)15-13-8-14(10-17-12(3)4)6-5-7-16(14)9-13/h11-13,15H,5-10H2,1-4H3
InChIKeyMAEACIPKJRIKMZ-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
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-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine?
The IUPAC name of N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine (CID 169289959) is N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine.
What is the SMILES notation for N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine?
The canonical SMILES for N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine is CC(C)NC1CN2CCCC2(COC(C)C)C1.
What is the InChIKey of N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine?
The InChIKey is MAEACIPKJRIKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11(2)15-13-8-14(10-17-12(3)4)6-5-7-16(14)9-13/h11-13,15H,5-10H2,1-4H3.
What are the key properties of N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine?
N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine has a molecular weight of 240.39 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-amine is sourced from PubChem (CID 169289959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).