N-methyloxane-4-carboxamide

C7H13NO2 — CID 22897465

IUPACN-methyloxane-4-carboxamide
SMILESCNC(=O)C1CCOCC1
InChIInChI=1S/C7H13NO2/c1-8-7(9)6-2-4-10-5-3-6/h6H,2-5H2,1H3,(H,8,9)
InChIKeyMGZFJPUAQNIUOD-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.16
Rot. Bonds1

About N-methyloxane-4-carboxamide

N-methyloxane-4-carboxamide (PubChem CID 22897465) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is N-methyloxane-4-carboxamide.

Molecular Properties

Compound NameN-methyloxane-4-carboxamide
PubChem CID22897465
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC NameN-methyloxane-4-carboxamide
SMILESCNC(=O)C1CCOCC1
InChIInChI=1S/C7H13NO2/c1-8-7(9)6-2-4-10-5-3-6/h6H,2-5H2,1H3,(H,8,9)
InChIKeyMGZFJPUAQNIUOD-UHFFFAOYSA-N
XLogP0.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyloxane-4-carboxamide?
The IUPAC name of N-methyloxane-4-carboxamide (CID 22897465) is N-methyloxane-4-carboxamide.
What is the SMILES notation for N-methyloxane-4-carboxamide?
The canonical SMILES for N-methyloxane-4-carboxamide is CNC(=O)C1CCOCC1.
What is the InChIKey of N-methyloxane-4-carboxamide?
The InChIKey is MGZFJPUAQNIUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-8-7(9)6-2-4-10-5-3-6/h6H,2-5H2,1H3,(H,8,9).
What are the key properties of N-methyloxane-4-carboxamide?
N-methyloxane-4-carboxamide has a molecular weight of 143.19 g/mol, XLogP of 0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyloxane-4-carboxamide is sourced from PubChem (CID 22897465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).