ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate

C15H26N2O3 — CID 2815507

IUPACethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C15H26N2O3/c1-2-20-15(19)17-10-8-13(9-11-17)16-14(18)12-6-4-3-5-7-12/h12-13H,2-11H2,1H3,(H,16,18)
InChIKeyFRZLDOVAKYVKIA-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.30
Rot. Bonds3

About ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate

ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate (PubChem CID 2815507) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate
PubChem CID2815507
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Nameethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C15H26N2O3/c1-2-20-15(19)17-10-8-13(9-11-17)16-14(18)12-6-4-3-5-7-12/h12-13H,2-11H2,1H3,(H,16,18)
InChIKeyFRZLDOVAKYVKIA-UHFFFAOYSA-N
XLogP2.30
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(R)-ethyl 3-(cyclohexanecarboxamido)-1,4'-bipiperidine-1'-carboxylate
CID 46872062
N-(piperidin-4-yl)cyclohexanecarboxamide
CID 1445167
ethyl 4-{[N-(cyclohexylcarbonyl)leucyl]amino}piperidine-1-carboxylate
CID 3244566
ethyl 4-({N-[(4-methylcyclohexyl)carbonyl]leucyl}amino)piperidine-1-carboxylate
CID 9550536
ethyl (1S,5R)-8-[2-(cyclohexanecarbonylamino)ethylamino]-3-azabicyclo[3.2.1]octane-3-carboxylate
CID 76327871
ethyl 4-[(3R)-3-(cyclopentanecarbonylamino)piperidin-1-yl]piperidine-1-carboxylate
CID 46873656
ethyl 4-[N-(cyclohexylcarbonyl)leucyl]piperazine-1-carboxylate
CID 3238124
ethyl 4-{N-[(4-methylcyclohexyl)carbonyl]valyl}piperazine-1-carboxylate
CID 3241156
Ethyl 4-(cyclohexanecarbonyl)piperazine-1-carboxylate
CID 750615
ethyl (1S,5R)-3-[2-(cyclohexanecarbonylamino)ethylamino]-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 70681453
N-((1-isopropylpiperidin-4-yl)methyl)cyclohexanecarboxamide
CID 16895432
N-[3-(4-methylpiperidin-1-yl)propyl]cyclohexanecarboxamide
CID 45850479

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate?
The IUPAC name of ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate (CID 2815507) is ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate?
The canonical SMILES for ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate is CCOC(=O)N1CCC(NC(=O)C2CCCCC2)CC1.
What is the InChIKey of ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate?
The InChIKey is FRZLDOVAKYVKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-2-20-15(19)17-10-8-13(9-11-17)16-14(18)12-6-4-3-5-7-12/h12-13H,2-11H2,1H3,(H,16,18).
What are the key properties of ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate?
ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate has a molecular weight of 282.38 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(cyclohexanecarbonylamino)piperidine-1-carboxylate is sourced from PubChem (CID 2815507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).