N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine

C12H24N2O — CID 62431858

IUPACN-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
SMILESCCC1COCCN1C(C)CNC1CC1
InChIInChI=1S/C12H24N2O/c1-3-12-9-15-7-6-14(12)10(2)8-13-11-4-5-11/h10-13H,3-9H2,1-2H3
InChIKeyBTYSFSGCUKLVEB-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.24
Rot. Bonds5

About N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine

N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine (PubChem CID 62431858) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
PubChem CID62431858
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
SMILESCCC1COCCN1C(C)CNC1CC1
InChIInChI=1S/C12H24N2O/c1-3-12-9-15-7-6-14(12)10(2)8-13-11-4-5-11/h10-13H,3-9H2,1-2H3
InChIKeyBTYSFSGCUKLVEB-UHFFFAOYSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine?
The IUPAC name of N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine (CID 62431858) is N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine.
What is the SMILES notation for N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine?
The canonical SMILES for N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine is CCC1COCCN1C(C)CNC1CC1.
What is the InChIKey of N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine?
The InChIKey is BTYSFSGCUKLVEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-3-12-9-15-7-6-14(12)10(2)8-13-11-4-5-11/h10-13H,3-9H2,1-2H3.
What are the key properties of N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine?
N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine has a molecular weight of 212.34 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine is sourced from PubChem (CID 62431858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).