4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide

C12H22N2O2 — CID 115869158

IUPAC4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)NC2CCOC2C)CC1
InChIInChI=1S/C12H22N2O2/c1-9-3-6-14(7-4-9)12(15)13-11-5-8-16-10(11)2/h9-11H,3-8H2,1-2H3,(H,13,15)
InChIKeyXADFQVLGSDJIPX-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.61
Rot. Bonds1

About 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide

4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide (PubChem CID 115869158) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide
PubChem CID115869158
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)NC2CCOC2C)CC1
InChIInChI=1S/C12H22N2O2/c1-9-3-6-14(7-4-9)12(15)13-11-5-8-16-10(11)2/h9-11H,3-8H2,1-2H3,(H,13,15)
InChIKeyXADFQVLGSDJIPX-UHFFFAOYSA-N
XLogP1.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide?
The IUPAC name of 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide (CID 115869158) is 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide is CC1CCN(C(=O)NC2CCOC2C)CC1.
What is the InChIKey of 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide?
The InChIKey is XADFQVLGSDJIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-9-3-6-14(7-4-9)12(15)13-11-5-8-16-10(11)2/h9-11H,3-8H2,1-2H3,(H,13,15).
What are the key properties of 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide?
4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methyloxolan-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 115869158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).