1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone

C14H25NO — CID 58151881

IUPAC1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone
SMILESCC1CCC(C(=O)CN2CCCCC2)CC1
InChIInChI=1S/C14H25NO/c1-12-5-7-13(8-6-12)14(16)11-15-9-3-2-4-10-15/h12-13H,2-11H2,1H3
InChIKeyNUHJHYQXNRKUBX-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.87
Rot. Bonds3

About 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone

1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone (PubChem CID 58151881) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone.

Molecular Properties

Compound Name1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone
PubChem CID58151881
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone
SMILESCC1CCC(C(=O)CN2CCCCC2)CC1
InChIInChI=1S/C14H25NO/c1-12-5-7-13(8-6-12)14(16)11-15-9-3-2-4-10-15/h12-13H,2-11H2,1H3
InChIKeyNUHJHYQXNRKUBX-UHFFFAOYSA-N
XLogP2.87
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone?
The IUPAC name of 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone (CID 58151881) is 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone.
What is the SMILES notation for 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone?
The canonical SMILES for 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone is CC1CCC(C(=O)CN2CCCCC2)CC1.
What is the InChIKey of 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone?
The InChIKey is NUHJHYQXNRKUBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-12-5-7-13(8-6-12)14(16)11-15-9-3-2-4-10-15/h12-13H,2-11H2,1H3.
What are the key properties of 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone?
1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone has a molecular weight of 223.36 g/mol, XLogP of 2.87, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylcyclohexyl)-2-piperidin-1-ylethanone is sourced from PubChem (CID 58151881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).