N-(3-methyloxan-3-yl)acetamide

C8H15NO2 — CID 103897018

IUPACN-(3-methyloxan-3-yl)acetamide
SMILESCC(=O)NC1(C)CCCOC1
InChIInChI=1S/C8H15NO2/c1-7(10)9-8(2)4-3-5-11-6-8/h3-6H2,1-2H3,(H,9,10)
InChIKeyBJNKOAFCMQEDMK-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.69
Rot. Bonds1

About N-(3-methyloxan-3-yl)acetamide

N-(3-methyloxan-3-yl)acetamide (PubChem CID 103897018) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-(3-methyloxan-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-methyloxan-3-yl)acetamide
PubChem CID103897018
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-(3-methyloxan-3-yl)acetamide
SMILESCC(=O)NC1(C)CCCOC1
InChIInChI=1S/C8H15NO2/c1-7(10)9-8(2)4-3-5-11-6-8/h3-6H2,1-2H3,(H,9,10)
InChIKeyBJNKOAFCMQEDMK-UHFFFAOYSA-N
XLogP0.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyloxan-3-yl)acetamide?
The IUPAC name of N-(3-methyloxan-3-yl)acetamide (CID 103897018) is N-(3-methyloxan-3-yl)acetamide.
What is the SMILES notation for N-(3-methyloxan-3-yl)acetamide?
The canonical SMILES for N-(3-methyloxan-3-yl)acetamide is CC(=O)NC1(C)CCCOC1.
What is the InChIKey of N-(3-methyloxan-3-yl)acetamide?
The InChIKey is BJNKOAFCMQEDMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-7(10)9-8(2)4-3-5-11-6-8/h3-6H2,1-2H3,(H,9,10).
What are the key properties of N-(3-methyloxan-3-yl)acetamide?
N-(3-methyloxan-3-yl)acetamide has a molecular weight of 157.21 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyloxan-3-yl)acetamide is sourced from PubChem (CID 103897018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).