[4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate

C13H24N2O2 — CID 175109270

IUPAC[4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate
SMILESCN1CCC(C2CCC(OC(N)=O)CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-15-8-6-11(7-9-15)10-2-4-12(5-3-10)17-13(14)16/h10-12H,2-9H2,1H3,(H2,14,16)
InChIKeyGFOOODIBRQEUDT-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.98
Rot. Bonds2

About [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate

[4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate (PubChem CID 175109270) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate.

Molecular Properties

Compound Name[4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate
PubChem CID175109270
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name[4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate
SMILESCN1CCC(C2CCC(OC(N)=O)CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-15-8-6-11(7-9-15)10-2-4-12(5-3-10)17-13(14)16/h10-12H,2-9H2,1H3,(H2,14,16)
InChIKeyGFOOODIBRQEUDT-UHFFFAOYSA-N
XLogP1.98
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,2,3,4-Tetramethylpiperidin-3-yl)butan-2-yl carbamate
CID 54565134
[4-[2-(Dimethylamino)ethyl]cyclohexyl] carbamate
CID 89753935
(4-Methyl-3-pentan-3-ylcyclohexyl) piperidine-1-carboxylate
CID 132040306
(3S,4S)-1-ethyl-3,4-dimethylpiperidine;(4-methylcyclohexyl) N-methylcarbamate;molecular hydrogen;propane;hydrofluoride
CID 144220443
[4-(2,2,6,6-Tetramethylpiperidin-4-yl)cyclohexyl] carbamate
CID 152771245
(3-Pentan-3-ylcyclohexyl) piperidine-1-carboxylate
CID 155276479
[8-Indiganyl-8-(1-methylpiperidin-4-yl)octan-4-yl] carbamate
CID 173270328
[(1R,2S)-2-propan-2-ylcyclohexyl] piperidine-1-carboxylate
CID 176856922

Frequently Asked Questions

What is the IUPAC name of [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate?
The IUPAC name of [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate (CID 175109270) is [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate.
What is the SMILES notation for [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate?
The canonical SMILES for [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate is CN1CCC(C2CCC(OC(N)=O)CC2)CC1.
What is the InChIKey of [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate?
The InChIKey is GFOOODIBRQEUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-15-8-6-11(7-9-15)10-2-4-12(5-3-10)17-13(14)16/h10-12H,2-9H2,1H3,(H2,14,16).
What are the key properties of [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate?
[4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate has a molecular weight of 240.35 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-methylpiperidin-4-yl)cyclohexyl] carbamate is sourced from PubChem (CID 175109270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).