N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide

C15H30N2O2 — CID 176795528

IUPACN-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)NCC1CCN(C(C)(C)C)CC1
InChIInChI=1S/C15H30N2O2/c1-12(2)19-11-14(18)16-10-13-6-8-17(9-7-13)15(3,4)5/h12-13H,6-11H2,1-5H3,(H,16,18)
InChIKeyAQUNLUDISMBACA-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.04
Rot. Bonds5

About N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide

N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide (PubChem CID 176795528) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide
PubChem CID176795528
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)NCC1CCN(C(C)(C)C)CC1
InChIInChI=1S/C15H30N2O2/c1-12(2)19-11-14(18)16-10-13-6-8-17(9-7-13)15(3,4)5/h12-13H,6-11H2,1-5H3,(H,16,18)
InChIKeyAQUNLUDISMBACA-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide?
The IUPAC name of N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide (CID 176795528) is N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide?
The canonical SMILES for N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide is CC(C)OCC(=O)NCC1CCN(C(C)(C)C)CC1.
What is the InChIKey of N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide?
The InChIKey is AQUNLUDISMBACA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-12(2)19-11-14(18)16-10-13-6-8-17(9-7-13)15(3,4)5/h12-13H,6-11H2,1-5H3,(H,16,18).
What are the key properties of N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide?
N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide has a molecular weight of 270.42 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide is sourced from PubChem (CID 176795528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).