1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine

C10H20N2 — CID 115301558

IUPAC1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine
SMILESCCC1CN(CC(N)C2CC2)C1
InChIInChI=1S/C10H20N2/c1-2-8-5-12(6-8)7-10(11)9-3-4-9/h8-10H,2-7,11H2,1H3
InChIKeyKROPWSLLPBKEGY-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.07
Rot. Bonds4

About 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine

1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine (PubChem CID 115301558) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine
PubChem CID115301558
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine
SMILESCCC1CN(CC(N)C2CC2)C1
InChIInChI=1S/C10H20N2/c1-2-8-5-12(6-8)7-10(11)9-3-4-9/h8-10H,2-7,11H2,1H3
InChIKeyKROPWSLLPBKEGY-UHFFFAOYSA-N
XLogP1.07
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine?
The IUPAC name of 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine (CID 115301558) is 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine.
What is the SMILES notation for 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine?
The canonical SMILES for 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine is CCC1CN(CC(N)C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine?
The InChIKey is KROPWSLLPBKEGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-2-8-5-12(6-8)7-10(11)9-3-4-9/h8-10H,2-7,11H2,1H3.
What are the key properties of 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine?
1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine has a molecular weight of 168.28 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(3-ethylazetidin-1-yl)ethanamine is sourced from PubChem (CID 115301558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).