N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide

C15H28N2O3 — CID 83033442

IUPACN-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide
SMILESCC1(C)CC(NC(=O)CCOC2CCNCC2)CCO1
InChIInChI=1S/C15H28N2O3/c1-15(2)11-12(5-10-20-15)17-14(18)6-9-19-13-3-7-16-8-4-13/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyYGKKCVFMHDXZCZ-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.22
Rot. Bonds5

About N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide

N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide (PubChem CID 83033442) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide
PubChem CID83033442
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC NameN-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide
SMILESCC1(C)CC(NC(=O)CCOC2CCNCC2)CCO1
InChIInChI=1S/C15H28N2O3/c1-15(2)11-12(5-10-20-15)17-14(18)6-9-19-13-3-7-16-8-4-13/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyYGKKCVFMHDXZCZ-UHFFFAOYSA-N
XLogP1.22
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide (CID 83033442) is N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide is CC1(C)CC(NC(=O)CCOC2CCNCC2)CCO1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide?
The InChIKey is YGKKCVFMHDXZCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-15(2)11-12(5-10-20-15)17-14(18)6-9-19-13-3-7-16-8-4-13/h12-13,16H,3-11H2,1-2H3,(H,17,18).
What are the key properties of N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide?
N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide has a molecular weight of 284.40 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 83033442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).