N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide

C13H24N2O — CID 175407496

IUPACN-(4-methylpiperidin-1-yl)cyclohexanecarboxamide
SMILESCC1CCN(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C13H24N2O/c1-11-7-9-15(10-8-11)14-13(16)12-5-3-2-4-6-12/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyYBKKHTWFRBBZHS-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.33
Rot. Bonds2

About N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide

N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide (PubChem CID 175407496) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(4-methylpiperidin-1-yl)cyclohexanecarboxamide
PubChem CID175407496
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-(4-methylpiperidin-1-yl)cyclohexanecarboxamide
SMILESCC1CCN(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C13H24N2O/c1-11-7-9-15(10-8-11)14-13(16)12-5-3-2-4-6-12/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyYBKKHTWFRBBZHS-UHFFFAOYSA-N
XLogP2.33
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide?
The IUPAC name of N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide (CID 175407496) is N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide.
What is the SMILES notation for N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide?
The canonical SMILES for N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide is CC1CCN(NC(=O)C2CCCCC2)CC1.
What is the InChIKey of N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide?
The InChIKey is YBKKHTWFRBBZHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-11-7-9-15(10-8-11)14-13(16)12-5-3-2-4-6-12/h11-12H,2-10H2,1H3,(H,14,16).
What are the key properties of N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide?
N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide has a molecular weight of 224.35 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperidin-1-yl)cyclohexanecarboxamide is sourced from PubChem (CID 175407496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).