tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate

C15H30N2O2 — CID 69286066

IUPACtert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate
SMILESCC(C)(C)NC1CCC(NC(=O)OC(C)(C)C)CC1
InChIInChI=1S/C15H30N2O2/c1-14(2,3)17-12-9-7-11(8-10-12)16-13(18)19-15(4,5)6/h11-12,17H,7-10H2,1-6H3,(H,16,18)
InChIKeyLHWTUHVNZRUODT-UHFFFAOYSA-N
MW270.42 g/mol
LogP3.21
Rot. Bonds2

About tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate

tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate (PubChem CID 69286066) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate
PubChem CID69286066
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Nametert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate
SMILESCC(C)(C)NC1CCC(NC(=O)OC(C)(C)C)CC1
InChIInChI=1S/C15H30N2O2/c1-14(2,3)17-12-9-7-11(8-10-12)16-13(18)19-15(4,5)6/h11-12,17H,7-10H2,1-6H3,(H,16,18)
InChIKeyLHWTUHVNZRUODT-UHFFFAOYSA-N
XLogP3.21
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-[3-(tert-butylamino)cyclobutyl]carbamate
CID 134462413
[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]azanium
CID 7021549
tert-butyl N-(4-arsanylcyclohexyl)carbamate
CID 173124516
tert-butyl N-(4-aminocyclohexyl)carbamate;dihydrochloride
CID 140801985
tert-butyl N-[4-(tert-butylcarbamoyl)cyclohexyl]carbamate
CID 59316038
tert-butyl N-(4-aminooxycyclohexyl)carbamate
CID 22408668
tert-butyl N-[4-(2,2-dimethylpropanoyl)cyclohexyl]carbamate
CID 59470733
tert-butyl N-piperidin-1-ium-4-ylcarbamate
CID 6927761
tert-butyl N-[4-(methylideneamino)cyclohexyl]carbamate
CID 138714983
tert-butyl N-[4-(3,3-dimethylbutanoylamino)cyclohexyl]carbamate
CID 86277406
tert-butyl N-[4-(oxiran-2-yl)cyclohexyl]carbamate
CID 87128955
tert-butyl N-[(1S,3S)-3-hydroxycyclopentyl]carbamate;tert-butyl N-[(1R,3R)-3-hydroxycyclopentyl]carbamate
CID 86222893

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate?
The IUPAC name of tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate (CID 69286066) is tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate.
What is the SMILES notation for tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate?
The canonical SMILES for tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate is CC(C)(C)NC1CCC(NC(=O)OC(C)(C)C)CC1.
What is the InChIKey of tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate?
The InChIKey is LHWTUHVNZRUODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-14(2,3)17-12-9-7-11(8-10-12)16-13(18)19-15(4,5)6/h11-12,17H,7-10H2,1-6H3,(H,16,18).
What are the key properties of tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate?
tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate has a molecular weight of 270.42 g/mol, XLogP of 3.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[4-(tert-butylamino)cyclohexyl]carbamate is sourced from PubChem (CID 69286066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).