3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide

C11H20N2O — CID 118330514

IUPAC3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide
SMILESCCC1(NC(=O)CCC2CNC2)CC1
InChIInChI=1S/C11H20N2O/c1-2-11(5-6-11)13-10(14)4-3-9-7-12-8-9/h9,12H,2-8H2,1H3,(H,13,14)
InChIKeyQANOFRLHZWXXQJ-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.04
Rot. Bonds5

About 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide

3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide (PubChem CID 118330514) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide.

Molecular Properties

Compound Name3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide
PubChem CID118330514
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide
SMILESCCC1(NC(=O)CCC2CNC2)CC1
InChIInChI=1S/C11H20N2O/c1-2-11(5-6-11)13-10(14)4-3-9-7-12-8-9/h9,12H,2-8H2,1H3,(H,13,14)
InChIKeyQANOFRLHZWXXQJ-UHFFFAOYSA-N
XLogP1.04
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide?
The IUPAC name of 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide (CID 118330514) is 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide.
What is the SMILES notation for 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide?
The canonical SMILES for 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide is CCC1(NC(=O)CCC2CNC2)CC1.
What is the InChIKey of 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide?
The InChIKey is QANOFRLHZWXXQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-2-11(5-6-11)13-10(14)4-3-9-7-12-8-9/h9,12H,2-8H2,1H3,(H,13,14).
What are the key properties of 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide?
3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide has a molecular weight of 196.29 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-3-yl)-N-(1-ethylcyclopropyl)propanamide is sourced from PubChem (CID 118330514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).