cyclobutyl carbamate;hydrochloride

C5H10ClNO2 — CID 174750611

IUPACcyclobutyl carbamate;hydrochloride
SMILESCl.NC(=O)OC1CCC1
InChIInChI=1S/C5H9NO2.ClH/c6-5(7)8-4-2-1-3-4;/h4H,1-3H2,(H2,6,7);1H
InChIKeyGYZDBMDOCGXDMG-UHFFFAOYSA-N
MW151.59 g/mol
LogP1.06
Rot. Bonds1

About cyclobutyl carbamate;hydrochloride

cyclobutyl carbamate;hydrochloride (PubChem CID 174750611) has the molecular formula C5H10ClNO2 and a molecular weight of 151.59 g/mol. Its IUPAC name is cyclobutyl carbamate;hydrochloride.

Molecular Properties

Compound Namecyclobutyl carbamate;hydrochloride
PubChem CID174750611
Molecular FormulaC5H10ClNO2
Molecular Weight151.59 g/mol
Exact Mass151.04
IUPAC Namecyclobutyl carbamate;hydrochloride
SMILESCl.NC(=O)OC1CCC1
InChIInChI=1S/C5H9NO2.ClH/c6-5(7)8-4-2-1-3-4;/h4H,1-3H2,(H2,6,7);1H
InChIKeyGYZDBMDOCGXDMG-UHFFFAOYSA-N
XLogP1.06
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.59
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclobutyl carbamate;hydrochloride?
The IUPAC name of cyclobutyl carbamate;hydrochloride (CID 174750611) is cyclobutyl carbamate;hydrochloride.
What is the SMILES notation for cyclobutyl carbamate;hydrochloride?
The canonical SMILES for cyclobutyl carbamate;hydrochloride is Cl.NC(=O)OC1CCC1.
What is the InChIKey of cyclobutyl carbamate;hydrochloride?
The InChIKey is GYZDBMDOCGXDMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2.ClH/c6-5(7)8-4-2-1-3-4;/h4H,1-3H2,(H2,6,7);1H.
What are the key properties of cyclobutyl carbamate;hydrochloride?
cyclobutyl carbamate;hydrochloride has a molecular weight of 151.59 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl carbamate;hydrochloride is sourced from PubChem (CID 174750611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).