N-(2-piperidin-4-yloxyethyl)cyclopropanamine

C10H20N2O — CID 63903398

IUPACN-(2-piperidin-4-yloxyethyl)cyclopropanamine
SMILESC1CC(OCCNC2CC2)CCN1
InChIInChI=1S/C10H20N2O/c1-2-9(1)12-7-8-13-10-3-5-11-6-4-10/h9-12H,1-8H2
InChIKeyZTYQGORYPNKKSW-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.51
Rot. Bonds5

About N-(2-piperidin-4-yloxyethyl)cyclopropanamine

N-(2-piperidin-4-yloxyethyl)cyclopropanamine (PubChem CID 63903398) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-(2-piperidin-4-yloxyethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2-piperidin-4-yloxyethyl)cyclopropanamine
PubChem CID63903398
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-(2-piperidin-4-yloxyethyl)cyclopropanamine
SMILESC1CC(OCCNC2CC2)CCN1
InChIInChI=1S/C10H20N2O/c1-2-9(1)12-7-8-13-10-3-5-11-6-4-10/h9-12H,1-8H2
InChIKeyZTYQGORYPNKKSW-UHFFFAOYSA-N
XLogP0.51
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.51
H-Bond Donors ≤ 52
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-(2-piperidin-4-yloxyethyl)cyclopropanamine?
The IUPAC name of N-(2-piperidin-4-yloxyethyl)cyclopropanamine (CID 63903398) is N-(2-piperidin-4-yloxyethyl)cyclopropanamine.
What is the SMILES notation for N-(2-piperidin-4-yloxyethyl)cyclopropanamine?
The canonical SMILES for N-(2-piperidin-4-yloxyethyl)cyclopropanamine is C1CC(OCCNC2CC2)CCN1.
What is the InChIKey of N-(2-piperidin-4-yloxyethyl)cyclopropanamine?
The InChIKey is ZTYQGORYPNKKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-9(1)12-7-8-13-10-3-5-11-6-4-10/h9-12H,1-8H2.
What are the key properties of N-(2-piperidin-4-yloxyethyl)cyclopropanamine?
N-(2-piperidin-4-yloxyethyl)cyclopropanamine has a molecular weight of 184.28 g/mol, XLogP of 0.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-4-yloxyethyl)cyclopropanamine is sourced from PubChem (CID 63903398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).