N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide

C14H25N3O3 — CID 66239261

IUPACN-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide
SMILESCC(C)C(=O)NC1CCN(C(=O)C2COCC2N)CC1
InChIInChI=1S/C14H25N3O3/c1-9(2)13(18)16-10-3-5-17(6-4-10)14(19)11-7-20-8-12(11)15/h9-12H,3-8,15H2,1-2H3,(H,16,18)
InChIKeyIFPXCDYXBRKDIY-UHFFFAOYSA-N
MW283.37 g/mol
LogP-0.28
Rot. Bonds3

About N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide

N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide (PubChem CID 66239261) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide
PubChem CID66239261
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC NameN-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide
SMILESCC(C)C(=O)NC1CCN(C(=O)C2COCC2N)CC1
InChIInChI=1S/C14H25N3O3/c1-9(2)13(18)16-10-3-5-17(6-4-10)14(19)11-7-20-8-12(11)15/h9-12H,3-8,15H2,1-2H3,(H,16,18)
InChIKeyIFPXCDYXBRKDIY-UHFFFAOYSA-N
XLogP-0.28
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide?
The IUPAC name of N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide (CID 66239261) is N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide.
What is the SMILES notation for N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide?
The canonical SMILES for N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide is CC(C)C(=O)NC1CCN(C(=O)C2COCC2N)CC1.
What is the InChIKey of N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide?
The InChIKey is IFPXCDYXBRKDIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-9(2)13(18)16-10-3-5-17(6-4-10)14(19)11-7-20-8-12(11)15/h9-12H,3-8,15H2,1-2H3,(H,16,18).
What are the key properties of N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide?
N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide has a molecular weight of 283.37 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-aminooxolane-3-carbonyl)piperidin-4-yl]-2-methylpropanamide is sourced from PubChem (CID 66239261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).