[(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate

C10H21NO4 — CID 91594264

IUPAC[(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate
SMILESCOC[C@H](COC(=O)NC(C)(C)C)OC
InChIInChI=1S/C10H21NO4/c1-10(2,3)11-9(12)15-7-8(14-5)6-13-4/h8H,6-7H2,1-5H3,(H,11,12)/t8-/m1/s1
InChIKeyDWFFPTABSFJZIL-MRVPVSSYSA-N
MW219.28 g/mol
LogP1.17
Rot. Bonds5

About [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate

[(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate (PubChem CID 91594264) has the molecular formula C10H21NO4 and a molecular weight of 219.28 g/mol. Its IUPAC name is [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate.

Molecular Properties

Compound Name[(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate
PubChem CID91594264
Molecular FormulaC10H21NO4
Molecular Weight219.28 g/mol
Exact Mass219.15
IUPAC Name[(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate
SMILESCOC[C@H](COC(=O)NC(C)(C)C)OC
InChIInChI=1S/C10H21NO4/c1-10(2,3)11-9(12)15-7-8(14-5)6-13-4/h8H,6-7H2,1-5H3,(H,11,12)/t8-/m1/s1
InChIKeyDWFFPTABSFJZIL-MRVPVSSYSA-N
XLogP1.17
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(S)-(-)-tert-butyl 1-hydroxypropan-2-yl carbamate
CID 118237081
propan-2-yl N-(1-fluoro-2-methylpropan-2-yl)carbamate
CID 138552400
[(2S)-1-(difluoromethoxy)propan-2-yl] N-tert-butylcarbamate
CID 157856930
[(2S)-2-(difluoromethoxy)propyl] N-tert-butylcarbamate
CID 175432714
[(2S)-1-(trifluoromethoxy)propan-2-yl] N-tert-butylcarbamate
CID 175571914
Propyl tert-butylcarbamate
CID 246800
oxolan-3-yl N-tert-butylcarbamate
CID 20765341
propan-2-yl N-tert-butylcarbamate
CID 58798528
2-methoxyethyl N-tert-butylcarbamate
CID 59083138
[(3S)-oxolan-3-yl] N-tert-butylcarbamate
CID 59990336
Tert-butyl [2-(2-methoxyethoxy)-1,1-dimethylethyl]carbamate
CID 86645526
oxiran-2-ylmethyl N-tert-butylcarbamate
CID 87453894

Frequently Asked Questions

What is the IUPAC name of [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate?
The IUPAC name of [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate (CID 91594264) is [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate.
What is the SMILES notation for [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate?
The canonical SMILES for [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate is COC[C@H](COC(=O)NC(C)(C)C)OC.
What is the InChIKey of [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate?
The InChIKey is DWFFPTABSFJZIL-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H21NO4/c1-10(2,3)11-9(12)15-7-8(14-5)6-13-4/h8H,6-7H2,1-5H3,(H,11,12)/t8-/m1/s1.
What are the key properties of [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate?
[(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate has a molecular weight of 219.28 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2,3-dimethoxypropyl] N-tert-butylcarbamate is sourced from PubChem (CID 91594264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).