N-methyl-N-(oxan-4-ylmethyl)propanamide

C10H19NO2 — CID 64592805

IUPACN-methyl-N-(oxan-4-ylmethyl)propanamide
SMILESCCC(=O)N(C)CC1CCOCC1
InChIInChI=1S/C10H19NO2/c1-3-10(12)11(2)8-9-4-6-13-7-5-9/h9H,3-8H2,1-2H3
InChIKeyOIXKUKPJTOVQLK-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.28
Rot. Bonds3

About N-methyl-N-(oxan-4-ylmethyl)propanamide

N-methyl-N-(oxan-4-ylmethyl)propanamide (PubChem CID 64592805) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-methyl-N-(oxan-4-ylmethyl)propanamide.

Molecular Properties

Compound NameN-methyl-N-(oxan-4-ylmethyl)propanamide
PubChem CID64592805
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-methyl-N-(oxan-4-ylmethyl)propanamide
SMILESCCC(=O)N(C)CC1CCOCC1
InChIInChI=1S/C10H19NO2/c1-3-10(12)11(2)8-9-4-6-13-7-5-9/h9H,3-8H2,1-2H3
InChIKeyOIXKUKPJTOVQLK-UHFFFAOYSA-N
XLogP1.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxan-4-ylmethyl)propanamide?
The IUPAC name of N-methyl-N-(oxan-4-ylmethyl)propanamide (CID 64592805) is N-methyl-N-(oxan-4-ylmethyl)propanamide.
What is the SMILES notation for N-methyl-N-(oxan-4-ylmethyl)propanamide?
The canonical SMILES for N-methyl-N-(oxan-4-ylmethyl)propanamide is CCC(=O)N(C)CC1CCOCC1.
What is the InChIKey of N-methyl-N-(oxan-4-ylmethyl)propanamide?
The InChIKey is OIXKUKPJTOVQLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-10(12)11(2)8-9-4-6-13-7-5-9/h9H,3-8H2,1-2H3.
What are the key properties of N-methyl-N-(oxan-4-ylmethyl)propanamide?
N-methyl-N-(oxan-4-ylmethyl)propanamide has a molecular weight of 185.27 g/mol, XLogP of 1.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxan-4-ylmethyl)propanamide is sourced from PubChem (CID 64592805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).