tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate

C16H30N2O2 — CID 53255880

IUPACtert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate
SMILESCC(C)(C)OC(=O)NC1CCN(C2CCCCC2)CC1
InChIInChI=1S/C16H30N2O2/c1-16(2,3)20-15(19)17-13-9-11-18(12-10-13)14-7-5-4-6-8-14/h13-14H,4-12H2,1-3H3,(H,17,19)
InChIKeyOAXXUWURHXATFA-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.31
Rot. Bonds2

About tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate

tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate (PubChem CID 53255880) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate
PubChem CID53255880
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Nametert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate
SMILESCC(C)(C)OC(=O)NC1CCN(C2CCCCC2)CC1
InChIInChI=1S/C16H30N2O2/c1-16(2,3)20-15(19)17-13-9-11-18(12-10-13)14-7-5-4-6-8-14/h13-14H,4-12H2,1-3H3,(H,17,19)
InChIKeyOAXXUWURHXATFA-UHFFFAOYSA-N
XLogP3.31
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-(1-cyclopentylpyrrolidin-3-yl)carbamate
CID 68513412
tert-butyl N-(1-cyclopropylazocan-5-yl)carbamate
CID 166867024
tert-butyl N-[1-(1-tert-butylpiperidin-4-yl)piperidin-4-yl]carbamate
CID 139430473
tert-butyl N-[1-(4-ethoxycyclohexyl)piperidin-4-yl]carbamate
CID 159168644
tert-butyl N-[1-(4-methoxy-4-methylcyclohexyl)piperidin-4-yl]carbamate
CID 91018778
tert-butyl N-[3-[(1-cyclobutylpiperidin-4-yl)amino]-3-oxopropyl]carbamate
CID 122152143
methyl N-(1-cyclohexylpyrrolidin-3-yl)carbamate
CID 110477693
tert-butyl N-[(3R)-1-cyclopropylpiperidin-3-yl]carbamate
CID 95912362
tert-butyl N-(1-methylpiperidin-4-yl)carbamate;ethane
CID 142994161
methyl 4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]piperazine-1-carboxylate
CID 166675225
ethyl 2-[4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]piperidin-1-yl]acetate
CID 126619796
tert-butyl N-[1-(pyrrolidine-1-carbonyl)piperidin-4-yl]carbamate
CID 46318296

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate?
The IUPAC name of tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate (CID 53255880) is tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate.
What is the SMILES notation for tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate?
The canonical SMILES for tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate is CC(C)(C)OC(=O)NC1CCN(C2CCCCC2)CC1.
What is the InChIKey of tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate?
The InChIKey is OAXXUWURHXATFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-16(2,3)20-15(19)17-13-9-11-18(12-10-13)14-7-5-4-6-8-14/h13-14H,4-12H2,1-3H3,(H,17,19).
What are the key properties of tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate?
tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate has a molecular weight of 282.43 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(1-cyclohexylpiperidin-4-yl)carbamate is sourced from PubChem (CID 53255880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).