N-(3-methyloxan-3-yl)butanamide

C10H19NO2 — CID 103896975

IUPACN-(3-methyloxan-3-yl)butanamide
SMILESCCCC(=O)NC1(C)CCCOC1
InChIInChI=1S/C10H19NO2/c1-3-5-9(12)11-10(2)6-4-7-13-8-10/h3-8H2,1-2H3,(H,11,12)
InChIKeyDNHAZEHWVDQHOZ-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.47
Rot. Bonds3

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

N-(3-methyloxan-3-yl)butanamide (PubChem CID 103896975) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-(3-methyloxan-3-yl)butanamide.

Molecular Properties

Compound NameN-(3-methyloxan-3-yl)butanamide
PubChem CID103896975
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-(3-methyloxan-3-yl)butanamide
SMILESCCCC(=O)NC1(C)CCCOC1
InChIInChI=1S/C10H19NO2/c1-3-5-9(12)11-10(2)6-4-7-13-8-10/h3-8H2,1-2H3,(H,11,12)
InChIKeyDNHAZEHWVDQHOZ-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.47
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)butanamide?
The IUPAC name of N-(3-methyloxan-3-yl)butanamide (CID 103896975) is N-(3-methyloxan-3-yl)butanamide.
What is the SMILES notation for N-(3-methyloxan-3-yl)butanamide?
The canonical SMILES for N-(3-methyloxan-3-yl)butanamide is CCCC(=O)NC1(C)CCCOC1.
What is the InChIKey of N-(3-methyloxan-3-yl)butanamide?
The InChIKey is DNHAZEHWVDQHOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-5-9(12)11-10(2)6-4-7-13-8-10/h3-8H2,1-2H3,(H,11,12).
What are the key properties of N-(3-methyloxan-3-yl)butanamide?
N-(3-methyloxan-3-yl)butanamide has a molecular weight of 185.27 g/mol, XLogP of 1.47, 3 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)butanamide is sourced from PubChem (CID 103896975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).