[4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone

C18H30N2O2 — CID 2238182

IUPAC[4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone
SMILESO=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
InChIInChI=1S/C18H30N2O2/c21-17(19-11-3-1-4-12-19)15-7-9-16(10-8-15)18(22)20-13-5-2-6-14-20/h15-16H,1-14H2
InChIKeyXTXAFENUDRXMGW-UHFFFAOYSA-N
MW306.45 g/mol
LogP2.82
Rot. Bonds2

About [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone

[4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone (PubChem CID 2238182) has the molecular formula C18H30N2O2 and a molecular weight of 306.45 g/mol. Its IUPAC name is [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone
PubChem CID2238182
Molecular FormulaC18H30N2O2
Molecular Weight306.45 g/mol
Exact Mass306.23
IUPAC Name[4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone
SMILESO=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1
InChIInChI=1S/C18H30N2O2/c21-17(19-11-3-1-4-12-19)15-7-9-16(10-8-15)18(22)20-13-5-2-6-14-20/h15-16H,1-14H2
InChIKeyXTXAFENUDRXMGW-UHFFFAOYSA-N
XLogP2.82
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone?
The IUPAC name of [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone (CID 2238182) is [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone.
What is the SMILES notation for [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone?
The canonical SMILES for [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone is O=C(C1CCC(C(=O)N2CCCCC2)CC1)N1CCCCC1.
What is the InChIKey of [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone?
The InChIKey is XTXAFENUDRXMGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O2/c21-17(19-11-3-1-4-12-19)15-7-9-16(10-8-15)18(22)20-13-5-2-6-14-20/h15-16H,1-14H2.
What are the key properties of [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone?
[4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone has a molecular weight of 306.45 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(piperidine-1-carbonyl)cyclohexyl]-piperidin-1-ylmethanone is sourced from PubChem (CID 2238182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).