N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide

C9H18N2O2 — CID 130667102

IUPACN-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide
SMILESCOC(C)C(=O)NC1(C)CN(C)C1
InChIInChI=1S/C9H18N2O2/c1-7(13-4)8(12)10-9(2)5-11(3)6-9/h7H,5-6H2,1-4H3,(H,10,12)
InChIKeyUCPMZJRWFXLNMP-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.16
Rot. Bonds3

About N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide

N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide (PubChem CID 130667102) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide.

Molecular Properties

Compound NameN-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide
PubChem CID130667102
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide
SMILESCOC(C)C(=O)NC1(C)CN(C)C1
InChIInChI=1S/C9H18N2O2/c1-7(13-4)8(12)10-9(2)5-11(3)6-9/h7H,5-6H2,1-4H3,(H,10,12)
InChIKeyUCPMZJRWFXLNMP-UHFFFAOYSA-N
XLogP-0.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide?
The IUPAC name of N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide (CID 130667102) is N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide.
What is the SMILES notation for N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide?
The canonical SMILES for N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide is COC(C)C(=O)NC1(C)CN(C)C1.
What is the InChIKey of N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide?
The InChIKey is UCPMZJRWFXLNMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-7(13-4)8(12)10-9(2)5-11(3)6-9/h7H,5-6H2,1-4H3,(H,10,12).
What are the key properties of N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide?
N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide has a molecular weight of 186.25 g/mol, XLogP of -0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylazetidin-3-yl)-2-methoxypropanamide is sourced from PubChem (CID 130667102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).