tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate

C10H20N2O2 — CID 71280569

IUPACtert-butyl N-(3-amino-3-methylcyclobutyl)carbamate
SMILESCC1(N)CC(NC(=O)OC(C)(C)C)C1
InChIInChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-7-5-10(4,11)6-7/h7H,5-6,11H2,1-4H3,(H,12,13)
InChIKeyIDZXBLNHGNNOSO-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.39
Rot. Bonds1

About tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate

tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate (PubChem CID 71280569) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(3-amino-3-methylcyclobutyl)carbamate
PubChem CID71280569
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nametert-butyl N-(3-amino-3-methylcyclobutyl)carbamate
SMILESCC1(N)CC(NC(=O)OC(C)(C)C)C1
InChIInChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-7-5-10(4,11)6-7/h7H,5-6,11H2,1-4H3,(H,12,13)
InChIKeyIDZXBLNHGNNOSO-UHFFFAOYSA-N
XLogP1.39
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)carbamate
CID 90701493
tert-butyl N-(3,3-dimethoxycyclobutyl)carbamate
CID 142054635
tert-butyl N-(6-aminospiro[3.3]heptan-2-yl)carbamate;hydrochloride
CID 146082168
tert-butyl N-(3,3-dicarbonofluoridoylcyclobutyl)carbamate
CID 155092613
tert-butyl N-spiro[3.3]heptan-2-ylcarbamate
CID 129317691
tert-butyl N-(2,2-dimethylcyclopropyl)carbamate
CID 65142866
tert-butyl N-(2,2-dimethyl-1,3-dioxan-5-yl)carbamate
CID 68605714
tert-butyl N-(2-azaspiro[3.3]heptan-6-yl)carbamate;hydrochloride
CID 86767491
tert-butyl N-(2-oxospiro[3.3]heptan-6-yl)carbamate
CID 39872257
tert-butyl N-[3-methyl-3-(propan-2-ylcarbamoyl)cyclobutyl]carbamate
CID 178017857
tert-butyl N-[(1R,5S)-5-hydroxy-3,3-dimethylcyclohexyl]carbamate
CID 90020389
6-aminospiro[3.3]heptan-2-ol;tert-butyl N-(2-hydroxyspiro[3.3]heptan-6-yl)carbamate;dihydrochloride
CID 157204517

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate?
The IUPAC name of tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate (CID 71280569) is tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate.
What is the SMILES notation for tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate?
The canonical SMILES for tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate is CC1(N)CC(NC(=O)OC(C)(C)C)C1.
What is the InChIKey of tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate?
The InChIKey is IDZXBLNHGNNOSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-7-5-10(4,11)6-7/h7H,5-6,11H2,1-4H3,(H,12,13).
What are the key properties of tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate?
tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate has a molecular weight of 200.28 g/mol, XLogP of 1.39, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(3-amino-3-methylcyclobutyl)carbamate is sourced from PubChem (CID 71280569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).