N-methyl-N-propyloxetane-3-carboxamide

C8H15NO2 — CID 131224079

IUPACN-methyl-N-propyloxetane-3-carboxamide
SMILESCCCN(C)C(=O)C1COC1
InChIInChI=1S/C8H15NO2/c1-3-4-9(2)8(10)7-5-11-6-7/h7H,3-6H2,1-2H3
InChIKeyHVYFUCPXAAHTAF-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.50
Rot. Bonds3

About N-methyl-N-propyloxetane-3-carboxamide

N-methyl-N-propyloxetane-3-carboxamide (PubChem CID 131224079) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-methyl-N-propyloxetane-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-propyloxetane-3-carboxamide
PubChem CID131224079
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-methyl-N-propyloxetane-3-carboxamide
SMILESCCCN(C)C(=O)C1COC1
InChIInChI=1S/C8H15NO2/c1-3-4-9(2)8(10)7-5-11-6-7/h7H,3-6H2,1-2H3
InChIKeyHVYFUCPXAAHTAF-UHFFFAOYSA-N
XLogP0.50
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propyloxetane-3-carboxamide?
The IUPAC name of N-methyl-N-propyloxetane-3-carboxamide (CID 131224079) is N-methyl-N-propyloxetane-3-carboxamide.
What is the SMILES notation for N-methyl-N-propyloxetane-3-carboxamide?
The canonical SMILES for N-methyl-N-propyloxetane-3-carboxamide is CCCN(C)C(=O)C1COC1.
What is the InChIKey of N-methyl-N-propyloxetane-3-carboxamide?
The InChIKey is HVYFUCPXAAHTAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-3-4-9(2)8(10)7-5-11-6-7/h7H,3-6H2,1-2H3.
What are the key properties of N-methyl-N-propyloxetane-3-carboxamide?
N-methyl-N-propyloxetane-3-carboxamide has a molecular weight of 157.21 g/mol, XLogP of 0.50, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propyloxetane-3-carboxamide is sourced from PubChem (CID 131224079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).