cyclohexyl-(3-methylpiperidin-1-yl)methanone

C13H23NO — CID 2915080

IUPACcyclohexyl-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C13H23NO/c1-11-6-5-9-14(10-11)13(15)12-7-3-2-4-8-12/h11-12H,2-10H2,1H3
InChIKeyNPXDSRAYXKEXAV-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.83
Rot. Bonds1

About cyclohexyl-(3-methylpiperidin-1-yl)methanone

cyclohexyl-(3-methylpiperidin-1-yl)methanone (PubChem CID 2915080) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is cyclohexyl-(3-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Namecyclohexyl-(3-methylpiperidin-1-yl)methanone
PubChem CID2915080
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Namecyclohexyl-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C13H23NO/c1-11-6-5-9-14(10-11)13(15)12-7-3-2-4-8-12/h11-12H,2-10H2,1H3
InChIKeyNPXDSRAYXKEXAV-UHFFFAOYSA-N
XLogP2.83
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(3-methylpiperidin-1-yl)methanone?
The IUPAC name of cyclohexyl-(3-methylpiperidin-1-yl)methanone (CID 2915080) is cyclohexyl-(3-methylpiperidin-1-yl)methanone.
What is the SMILES notation for cyclohexyl-(3-methylpiperidin-1-yl)methanone?
The canonical SMILES for cyclohexyl-(3-methylpiperidin-1-yl)methanone is CC1CCCN(C(=O)C2CCCCC2)C1.
What is the InChIKey of cyclohexyl-(3-methylpiperidin-1-yl)methanone?
The InChIKey is NPXDSRAYXKEXAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-11-6-5-9-14(10-11)13(15)12-7-3-2-4-8-12/h11-12H,2-10H2,1H3.
What are the key properties of cyclohexyl-(3-methylpiperidin-1-yl)methanone?
cyclohexyl-(3-methylpiperidin-1-yl)methanone has a molecular weight of 209.33 g/mol, XLogP of 2.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(3-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 2915080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).