tert-butyl N-(cyclobutylmethylamino)carbamate

C10H20N2O2 — CID 58693863

IUPACtert-butyl N-(cyclobutylmethylamino)carbamate
SMILESCC(C)(C)OC(=O)NNCC1CCC1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-11-7-8-5-4-6-8/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyGXGICYKWKHWPFX-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.82
Rot. Bonds3

About tert-butyl N-(cyclobutylmethylamino)carbamate

tert-butyl N-(cyclobutylmethylamino)carbamate (PubChem CID 58693863) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is tert-butyl N-(cyclobutylmethylamino)carbamate.

Molecular Properties

Compound Nametert-butyl N-(cyclobutylmethylamino)carbamate
PubChem CID58693863
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nametert-butyl N-(cyclobutylmethylamino)carbamate
SMILESCC(C)(C)OC(=O)NNCC1CCC1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-11-7-8-5-4-6-8/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyGXGICYKWKHWPFX-UHFFFAOYSA-N
XLogP1.82
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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tert-butyl N-(cyclobutylmethyl)carbamate
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tert-butyl N-[(2-cyclohexylacetyl)amino]carbamate
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tert-butyl N-[(3,5-dimethylcyclohex-3-en-1-yl)methylamino]carbamate
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tert-butyl N-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexyl]methyl]carbamate
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tert-butyl N-(cyclododecylamino)carbamate
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acetic acid;tert-butyl N-(cyclohexylmethyl)carbamate
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tert-butyl N-[[(1R,3S)-3-methylcyclohexyl]methyl]carbamate
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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(cyclobutylmethylamino)carbamate?
The IUPAC name of tert-butyl N-(cyclobutylmethylamino)carbamate (CID 58693863) is tert-butyl N-(cyclobutylmethylamino)carbamate.
What is the SMILES notation for tert-butyl N-(cyclobutylmethylamino)carbamate?
The canonical SMILES for tert-butyl N-(cyclobutylmethylamino)carbamate is CC(C)(C)OC(=O)NNCC1CCC1.
What is the InChIKey of tert-butyl N-(cyclobutylmethylamino)carbamate?
The InChIKey is GXGICYKWKHWPFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-11-7-8-5-4-6-8/h8,11H,4-7H2,1-3H3,(H,12,13).
What are the key properties of tert-butyl N-(cyclobutylmethylamino)carbamate?
tert-butyl N-(cyclobutylmethylamino)carbamate has a molecular weight of 200.28 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(cyclobutylmethylamino)carbamate is sourced from PubChem (CID 58693863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).