ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate

C15H25NO3 — CID 2914232

IUPACethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate
SMILESCCOC(=O)C1CCCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C15H25NO3/c1-2-19-15(18)13-9-6-10-16(11-13)14(17)12-7-4-3-5-8-12/h12-13H,2-11H2,1H3
InChIKeyFYMFCEBFUPVADY-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.37
Rot. Bonds3

About ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate

ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate (PubChem CID 2914232) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate.

Molecular Properties

Compound Nameethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate
PubChem CID2914232
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Nameethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate
SMILESCCOC(=O)C1CCCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C15H25NO3/c1-2-19-15(18)13-9-6-10-16(11-13)14(17)12-7-4-3-5-8-12/h12-13H,2-11H2,1H3
InChIKeyFYMFCEBFUPVADY-UHFFFAOYSA-N
XLogP2.37
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Ethyl 1-(cyclohexylcarbonyl)piperidine-4-carboxylate
CID 808378
Methyl 1-(cyclohexylcarbonyl)-4-piperidinecarboxylate
CID 798678
Ethyl 1-pentanoyl-3-piperidinecarboxylate
CID 2957207
Ethyl 1-propionyl-3-piperidinecarboxylate
CID 2952241
Ethyl 1-cyclopropanecarbonylpiperidine-3-carboxylate
CID 43404451
3-Cyclohexyl-1-(3-(methoxymethyl)piperidin-1-yl)propan-1-one
CID 52992865
Cyclohexyl-[4-(2-methoxyethyl)piperidin-1-yl]methanone
CID 53150806
3-Cyclohexyl-1-[4-(2-methoxyethyl)piperidin-1-yl]propan-1-one
CID 53150835
2-Cyclohexyl-1-[4-(2-methoxyethyl)piperidin-1-yl]ethanone
CID 53150837
N-ethyl-3-carbethoxy-2-piperidone
CID 91239412
ethyl (3S)-1-(3-ethoxypropanoyl)piperidine-3-carboxylate
CID 7368612
Isonipecotic acid, N-(cyclohexylcarbonyl)-, propyl ester
CID 91725731

Frequently Asked Questions

What is the IUPAC name of ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate?
The IUPAC name of ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate (CID 2914232) is ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate.
What is the SMILES notation for ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate?
The canonical SMILES for ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate is CCOC(=O)C1CCCN(C(=O)C2CCCCC2)C1.
What is the InChIKey of ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate?
The InChIKey is FYMFCEBFUPVADY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-2-19-15(18)13-9-6-10-16(11-13)14(17)12-7-4-3-5-8-12/h12-13H,2-11H2,1H3.
What are the key properties of ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate?
ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate has a molecular weight of 267.37 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-(cyclohexanecarbonyl)piperidine-3-carboxylate is sourced from PubChem (CID 2914232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).