N-(3-morpholin-4-ylpropyl)cyclopropanamine

C10H20N2O — CID 60866748

IUPACN-(3-morpholin-4-ylpropyl)cyclopropanamine
SMILESC(CNC1CC1)CN1CCOCC1
InChIInChI=1S/C10H20N2O/c1(4-11-10-2-3-10)5-12-6-8-13-9-7-12/h10-11H,1-9H2
InChIKeyGELZRGIVDIYSRH-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.46
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)cyclopropanamine

N-(3-morpholin-4-ylpropyl)cyclopropanamine (PubChem CID 60866748) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)cyclopropanamine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)cyclopropanamine
PubChem CID60866748
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-(3-morpholin-4-ylpropyl)cyclopropanamine
SMILESC(CNC1CC1)CN1CCOCC1
InChIInChI=1S/C10H20N2O/c1(4-11-10-2-3-10)5-12-6-8-13-9-7-12/h10-11H,1-9H2
InChIKeyGELZRGIVDIYSRH-UHFFFAOYSA-N
XLogP0.46
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)cyclopropanamine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)cyclopropanamine (CID 60866748) is N-(3-morpholin-4-ylpropyl)cyclopropanamine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)cyclopropanamine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)cyclopropanamine is C(CNC1CC1)CN1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)cyclopropanamine?
The InChIKey is GELZRGIVDIYSRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1(4-11-10-2-3-10)5-12-6-8-13-9-7-12/h10-11H,1-9H2.
What are the key properties of N-(3-morpholin-4-ylpropyl)cyclopropanamine?
N-(3-morpholin-4-ylpropyl)cyclopropanamine has a molecular weight of 184.28 g/mol, XLogP of 0.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)cyclopropanamine is sourced from PubChem (CID 60866748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).