N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide

C13H22N2O — CID 81480295

IUPACN-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide
SMILESCN(C(=O)C1C2CCCC21)C1CCNCC1
InChIInChI=1S/C13H22N2O/c1-15(9-5-7-14-8-6-9)13(16)12-10-3-2-4-11(10)12/h9-12,14H,2-8H2,1H3
InChIKeyGWSBDSVDTMXZHT-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.24
Rot. Bonds2

About N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide

N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide (PubChem CID 81480295) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide.

Molecular Properties

Compound NameN-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide
PubChem CID81480295
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide
SMILESCN(C(=O)C1C2CCCC21)C1CCNCC1
InChIInChI=1S/C13H22N2O/c1-15(9-5-7-14-8-6-9)13(16)12-10-3-2-4-11(10)12/h9-12,14H,2-8H2,1H3
InChIKeyGWSBDSVDTMXZHT-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide?
The IUPAC name of N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide (CID 81480295) is N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide.
What is the SMILES notation for N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide?
The canonical SMILES for N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide is CN(C(=O)C1C2CCCC21)C1CCNCC1.
What is the InChIKey of N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide?
The InChIKey is GWSBDSVDTMXZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-15(9-5-7-14-8-6-9)13(16)12-10-3-2-4-11(10)12/h9-12,14H,2-8H2,1H3.
What are the key properties of N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide?
N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide has a molecular weight of 222.33 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-piperidin-4-ylbicyclo[3.1.0]hexane-6-carboxamide is sourced from PubChem (CID 81480295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).