[(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate

C10H17NO3 — CID 134570756

IUPAC[(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate
SMILESCN(C)C(=O)O[C@@](C)(C=O)CC1CC1
InChIInChI=1S/C10H17NO3/c1-10(7-12,6-8-4-5-8)14-9(13)11(2)3/h7-8H,4-6H2,1-3H3/t10-/m1/s1
InChIKeyLEHHMDSMHRFTGL-SNVBAGLBSA-N
MW199.25 g/mol
LogP1.44
Rot. Bonds4

About [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate

[(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate (PubChem CID 134570756) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate.

Molecular Properties

Compound Name[(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate
PubChem CID134570756
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name[(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate
SMILESCN(C)C(=O)O[C@@](C)(C=O)CC1CC1
InChIInChI=1S/C10H17NO3/c1-10(7-12,6-8-4-5-8)14-9(13)11(2)3/h7-8H,4-6H2,1-3H3/t10-/m1/s1
InChIKeyLEHHMDSMHRFTGL-SNVBAGLBSA-N
XLogP1.44
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate?
The IUPAC name of [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate (CID 134570756) is [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate.
What is the SMILES notation for [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate?
The canonical SMILES for [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate is CN(C)C(=O)O[C@@](C)(C=O)CC1CC1.
What is the InChIKey of [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate?
The InChIKey is LEHHMDSMHRFTGL-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H17NO3/c1-10(7-12,6-8-4-5-8)14-9(13)11(2)3/h7-8H,4-6H2,1-3H3/t10-/m1/s1.
What are the key properties of [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate?
[(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate has a molecular weight of 199.25 g/mol, XLogP of 1.44, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-cyclopropyl-2-methyl-3-oxopropan-2-yl] N,N-dimethylcarbamate is sourced from PubChem (CID 134570756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).