2-[azetidin-3-yl(methyl)amino]propanamide

C7H15N3O — CID 66188290

IUPAC2-[azetidin-3-yl(methyl)amino]propanamide
SMILESCC(C(N)=O)N(C)C1CNC1
InChIInChI=1S/C7H15N3O/c1-5(7(8)11)10(2)6-3-9-4-6/h5-6,9H,3-4H2,1-2H3,(H2,8,11)
InChIKeyBKTAICLHZSPBPI-UHFFFAOYSA-N
MW157.22 g/mol
LogP-1.24
Rot. Bonds3

About 2-[azetidin-3-yl(methyl)amino]propanamide

2-[azetidin-3-yl(methyl)amino]propanamide (PubChem CID 66188290) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 2-[azetidin-3-yl(methyl)amino]propanamide.

Molecular Properties

Compound Name2-[azetidin-3-yl(methyl)amino]propanamide
PubChem CID66188290
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name2-[azetidin-3-yl(methyl)amino]propanamide
SMILESCC(C(N)=O)N(C)C1CNC1
InChIInChI=1S/C7H15N3O/c1-5(7(8)11)10(2)6-3-9-4-6/h5-6,9H,3-4H2,1-2H3,(H2,8,11)
InChIKeyBKTAICLHZSPBPI-UHFFFAOYSA-N
XLogP-1.24
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-1.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[azetidin-3-yl(methyl)amino]propanamide?
The IUPAC name of 2-[azetidin-3-yl(methyl)amino]propanamide (CID 66188290) is 2-[azetidin-3-yl(methyl)amino]propanamide.
What is the SMILES notation for 2-[azetidin-3-yl(methyl)amino]propanamide?
The canonical SMILES for 2-[azetidin-3-yl(methyl)amino]propanamide is CC(C(N)=O)N(C)C1CNC1.
What is the InChIKey of 2-[azetidin-3-yl(methyl)amino]propanamide?
The InChIKey is BKTAICLHZSPBPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-5(7(8)11)10(2)6-3-9-4-6/h5-6,9H,3-4H2,1-2H3,(H2,8,11).
What are the key properties of 2-[azetidin-3-yl(methyl)amino]propanamide?
2-[azetidin-3-yl(methyl)amino]propanamide has a molecular weight of 157.22 g/mol, XLogP of -1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[azetidin-3-yl(methyl)amino]propanamide is sourced from PubChem (CID 66188290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).