2,3-dimethylbutan-2-yl carbamate

C7H15NO2 — CID 20975410

IUPAC2,3-dimethylbutan-2-yl carbamate
SMILESCC(C)C(C)(C)OC(N)=O
InChIInChI=1S/C7H15NO2/c1-5(2)7(3,4)10-6(8)9/h5H,1-4H3,(H2,8,9)
InChIKeyBDRUPJIDTGOQHD-UHFFFAOYSA-N
MW145.20 g/mol
LogP1.52
Rot. Bonds2

About 2,3-dimethylbutan-2-yl carbamate

2,3-dimethylbutan-2-yl carbamate (PubChem CID 20975410) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-yl carbamate.

Molecular Properties

Compound Name2,3-dimethylbutan-2-yl carbamate
PubChem CID20975410
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name2,3-dimethylbutan-2-yl carbamate
SMILESCC(C)C(C)(C)OC(N)=O
InChIInChI=1S/C7H15NO2/c1-5(2)7(3,4)10-6(8)9/h5H,1-4H3,(H2,8,9)
InChIKeyBDRUPJIDTGOQHD-UHFFFAOYSA-N
XLogP1.52
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-amino-4-imino-2,3-dimethylbutan-2-yl) carbamate
CID 174596017
(2-carbamoyloxy-3-methylbutan-2-yl) carbamate
CID 54113594
tert-butyl carbamate;2,4-dimethylpentane
CID 177025582
tert-butyl carbamate;molecular nitrogen
CID 176888665
[(4S)-4-methanimidoyl-2,3-dimethylhexan-2-yl] carbamate
CID 174590998
[(5S)-5-amino-2-methylhexan-2-yl] carbamate
CID 174841923
[(5S)-5-hydroxy-2-methylhexan-2-yl] carbamate
CID 121226929
2,3-dimethylbutan-2-yl N-sulfamoylcarbamate
CID 122596778
2,3-dimethylbutan-2-yl 2-ethyl-4,4-dimethylpentanoate
CID 123149081
[(4R)-4-methanimidoyl-2,3-dimethylhexan-2-yl] carbamate;hydrochloride
CID 174605763
[5-[4-(hydroxymethyl)cyclohexyl]-2,3-dimethylpentan-2-yl] carbamate
CID 150132149
2-methyl-2-propan-2-ylpropanediamide
CID 45122126

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutan-2-yl carbamate?
The IUPAC name of 2,3-dimethylbutan-2-yl carbamate (CID 20975410) is 2,3-dimethylbutan-2-yl carbamate.
What is the SMILES notation for 2,3-dimethylbutan-2-yl carbamate?
The canonical SMILES for 2,3-dimethylbutan-2-yl carbamate is CC(C)C(C)(C)OC(N)=O.
What is the InChIKey of 2,3-dimethylbutan-2-yl carbamate?
The InChIKey is BDRUPJIDTGOQHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-5(2)7(3,4)10-6(8)9/h5H,1-4H3,(H2,8,9).
What are the key properties of 2,3-dimethylbutan-2-yl carbamate?
2,3-dimethylbutan-2-yl carbamate has a molecular weight of 145.20 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-yl carbamate is sourced from PubChem (CID 20975410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).