cyclohexyl formate;piperidine

C12H23NO2 — CID 174620943

IUPACcyclohexyl formate;piperidine
SMILESC1CCNCC1.O=COC1CCCCC1
InChIInChI=1S/C7H12O2.C5H11N/c8-6-9-7-4-2-1-3-5-7;1-2-4-6-5-3-1/h6-7H,1-5H2;6H,1-5H2
InChIKeyKVYOCHHETDVGPS-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.25
Rot. Bonds2

About cyclohexyl formate;piperidine

cyclohexyl formate;piperidine (PubChem CID 174620943) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is cyclohexyl formate;piperidine.

Molecular Properties

Compound Namecyclohexyl formate;piperidine
PubChem CID174620943
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Namecyclohexyl formate;piperidine
SMILESC1CCNCC1.O=COC1CCCCC1
InChIInChI=1S/C7H12O2.C5H11N/c8-6-9-7-4-2-1-3-5-7;1-2-4-6-5-3-1/h6-7H,1-5H2;6H,1-5H2
InChIKeyKVYOCHHETDVGPS-UHFFFAOYSA-N
XLogP2.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

cyclononyl formate
CID 87065625
aniline;cyclohexyl formate
CID 160794609
methyl formate;pyrrolidine
CID 142871374
azacycloheptadecane
CID 22627811
azepane;piperidine
CID 67415778
1,12,23,34-tetrazacyclotetratetracontane
CID 15722582
1,6,13-triazacyclononadecane
CID 71376561
1,8,15,22-tetrazacyclooctacosane
CID 15722579
azacyclotriacontane
CID 57238597
(4-chlorocyclohexyl) formate
CID 21249018
oxophosphanium;pyrrolidine
CID 160540028
azonane;manganese
CID 57468151

Frequently Asked Questions

What is the IUPAC name of cyclohexyl formate;piperidine?
The IUPAC name of cyclohexyl formate;piperidine (CID 174620943) is cyclohexyl formate;piperidine.
What is the SMILES notation for cyclohexyl formate;piperidine?
The canonical SMILES for cyclohexyl formate;piperidine is C1CCNCC1.O=COC1CCCCC1.
What is the InChIKey of cyclohexyl formate;piperidine?
The InChIKey is KVYOCHHETDVGPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O2.C5H11N/c8-6-9-7-4-2-1-3-5-7;1-2-4-6-5-3-1/h6-7H,1-5H2;6H,1-5H2.
What are the key properties of cyclohexyl formate;piperidine?
cyclohexyl formate;piperidine has a molecular weight of 213.32 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl formate;piperidine is sourced from PubChem (CID 174620943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).