N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine

C13H26N2O — CID 103273656

IUPACN-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine
SMILESCN(C)CCOC1(CCNC2CC2)CCC1
InChIInChI=1S/C13H26N2O/c1-15(2)10-11-16-13(6-3-7-13)8-9-14-12-4-5-12/h12,14H,3-11H2,1-2H3
InChIKeyAHMNHJPNHKSZQI-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.63
Rot. Bonds8

About N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine

N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine (PubChem CID 103273656) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine
PubChem CID103273656
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine
SMILESCN(C)CCOC1(CCNC2CC2)CCC1
InChIInChI=1S/C13H26N2O/c1-15(2)10-11-16-13(6-3-7-13)8-9-14-12-4-5-12/h12,14H,3-11H2,1-2H3
InChIKeyAHMNHJPNHKSZQI-UHFFFAOYSA-N
XLogP1.63
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine?
The IUPAC name of N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine (CID 103273656) is N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine.
What is the SMILES notation for N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine?
The canonical SMILES for N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine is CN(C)CCOC1(CCNC2CC2)CCC1.
What is the InChIKey of N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine?
The InChIKey is AHMNHJPNHKSZQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-15(2)10-11-16-13(6-3-7-13)8-9-14-12-4-5-12/h12,14H,3-11H2,1-2H3.
What are the key properties of N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine?
N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine has a molecular weight of 226.36 g/mol, XLogP of 1.63, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]ethyl]cyclopropanamine is sourced from PubChem (CID 103273656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).