N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine

C12H25N3O — CID 66215890

IUPACN-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine
SMILESCCCN(CCN1CCOCC1)C1CNC1
InChIInChI=1S/C12H25N3O/c1-2-3-15(12-10-13-11-12)5-4-14-6-8-16-9-7-14/h12-13H,2-11H2,1H3
InChIKeyKGFZPBXGEMQFFP-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.00
Rot. Bonds6

About N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine

N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine (PubChem CID 66215890) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine
PubChem CID66215890
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine
SMILESCCCN(CCN1CCOCC1)C1CNC1
InChIInChI=1S/C12H25N3O/c1-2-3-15(12-10-13-11-12)5-4-14-6-8-16-9-7-14/h12-13H,2-11H2,1H3
InChIKeyKGFZPBXGEMQFFP-UHFFFAOYSA-N
XLogP0.00
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine?
The IUPAC name of N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine (CID 66215890) is N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine is CCCN(CCN1CCOCC1)C1CNC1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine?
The InChIKey is KGFZPBXGEMQFFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-2-3-15(12-10-13-11-12)5-4-14-6-8-16-9-7-14/h12-13H,2-11H2,1H3.
What are the key properties of N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine?
N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine has a molecular weight of 227.35 g/mol, XLogP of 0.00, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine is sourced from PubChem (CID 66215890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).