tert-butyl N-(cyclobutylmethyl)carbamate

C10H19NO2 — CID 23087339

IUPACtert-butyl N-(cyclobutylmethyl)carbamate
SMILESCC(C)(C)OC(=O)NCC1CCC1
InChIInChI=1S/C10H19NO2/c1-10(2,3)13-9(12)11-7-8-5-4-6-8/h8H,4-7H2,1-3H3,(H,11,12)
InChIKeyIYIJVINQYQBGFU-UHFFFAOYSA-N
MW185.27 g/mol
LogP2.31
Rot. Bonds2

About tert-butyl N-(cyclobutylmethyl)carbamate

tert-butyl N-(cyclobutylmethyl)carbamate (PubChem CID 23087339) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is tert-butyl N-(cyclobutylmethyl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(cyclobutylmethyl)carbamate
PubChem CID23087339
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Nametert-butyl N-(cyclobutylmethyl)carbamate
SMILESCC(C)(C)OC(=O)NCC1CCC1
InChIInChI=1S/C10H19NO2/c1-10(2,3)13-9(12)11-7-8-5-4-6-8/h8H,4-7H2,1-3H3,(H,11,12)
InChIKeyIYIJVINQYQBGFU-UHFFFAOYSA-N
XLogP2.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl N-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexyl]methyl]carbamate
CID 22668023
acetic acid;tert-butyl N-(cyclohexylmethyl)carbamate
CID 18446943
tert-butyl N-[[(1R,3S)-3-methylcyclohexyl]methyl]carbamate
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tert-butyl N-[(3-bromocyclohexyl)methyl]carbamate
CID 104701959
tert-butyl N-(oxan-3-ylmethyl)carbamate
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tert-butyl N-[(1-cyclobutylpiperidin-4-yl)methyl]carbamate
CID 53256365
tert-butyl N-[[4-(methylamino)cyclohexyl]methyl]carbamate
CID 58962901
tert-butyl N-(cyclobutylmethylamino)carbamate
CID 58693863
tert-butyl N-[(4-hydroxy-4-methylcyclohexyl)methyl]carbamate
CID 86647903
tert-butyl N-[[2-(cycloheptylmethylamino)cyclopentyl]methyl]carbamate
CID 107251493
tert-butyl N-[(2-bromocyclopentyl)methyl]carbamate
CID 114313805
tert-butyl N-[3-(cyclopentylmethylamino)propyl]carbamate;hydrochloride
CID 119031291

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(cyclobutylmethyl)carbamate?
The IUPAC name of tert-butyl N-(cyclobutylmethyl)carbamate (CID 23087339) is tert-butyl N-(cyclobutylmethyl)carbamate.
What is the SMILES notation for tert-butyl N-(cyclobutylmethyl)carbamate?
The canonical SMILES for tert-butyl N-(cyclobutylmethyl)carbamate is CC(C)(C)OC(=O)NCC1CCC1.
What is the InChIKey of tert-butyl N-(cyclobutylmethyl)carbamate?
The InChIKey is IYIJVINQYQBGFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-10(2,3)13-9(12)11-7-8-5-4-6-8/h8H,4-7H2,1-3H3,(H,11,12).
What are the key properties of tert-butyl N-(cyclobutylmethyl)carbamate?
tert-butyl N-(cyclobutylmethyl)carbamate has a molecular weight of 185.27 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(cyclobutylmethyl)carbamate is sourced from PubChem (CID 23087339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).