propan-2-yl N-cyclopropylcarbamate

C7H13NO2 — CID 57225012

IUPACpropan-2-yl N-cyclopropylcarbamate
SMILESCC(C)OC(=O)NC1CC1
InChIInChI=1S/C7H13NO2/c1-5(2)10-7(9)8-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,8,9)
InChIKeyNAOYBKMZUCATMV-UHFFFAOYSA-N
MW143.19 g/mol
LogP1.28
Rot. Bonds2

About propan-2-yl N-cyclopropylcarbamate

propan-2-yl N-cyclopropylcarbamate (PubChem CID 57225012) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is propan-2-yl N-cyclopropylcarbamate.

Molecular Properties

Compound Namepropan-2-yl N-cyclopropylcarbamate
PubChem CID57225012
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Namepropan-2-yl N-cyclopropylcarbamate
SMILESCC(C)OC(=O)NC1CC1
InChIInChI=1S/C7H13NO2/c1-5(2)10-7(9)8-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,8,9)
InChIKeyNAOYBKMZUCATMV-UHFFFAOYSA-N
XLogP1.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-cyclopropylcarbamate?
The IUPAC name of propan-2-yl N-cyclopropylcarbamate (CID 57225012) is propan-2-yl N-cyclopropylcarbamate.
What is the SMILES notation for propan-2-yl N-cyclopropylcarbamate?
The canonical SMILES for propan-2-yl N-cyclopropylcarbamate is CC(C)OC(=O)NC1CC1.
What is the InChIKey of propan-2-yl N-cyclopropylcarbamate?
The InChIKey is NAOYBKMZUCATMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-5(2)10-7(9)8-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,8,9).
What are the key properties of propan-2-yl N-cyclopropylcarbamate?
propan-2-yl N-cyclopropylcarbamate has a molecular weight of 143.19 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-cyclopropylcarbamate is sourced from PubChem (CID 57225012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).