2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate

C10H18NO4- — CID 57375900

IUPAC2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate
SMILESCC(C)C1OCCN1C(C)COC(=O)[O-]
InChIInChI=1S/C10H19NO4/c1-7(2)9-11(4-5-14-9)8(3)6-15-10(12)13/h7-9H,4-6H2,1-3H3,(H,12,13)/p-1
InChIKeyUFGYAMMZYIWKDX-UHFFFAOYSA-M
MW216.26 g/mol
LogP0.05
Rot. Bonds4

About 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate

2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate (PubChem CID 57375900) has the molecular formula C10H18NO4- and a molecular weight of 216.26 g/mol. Its IUPAC name is 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate.

Molecular Properties

Compound Name2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate
PubChem CID57375900
Molecular FormulaC10H18NO4-
Molecular Weight216.26 g/mol
Exact Mass216.12
IUPAC Name2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate
SMILESCC(C)C1OCCN1C(C)COC(=O)[O-]
InChIInChI=1S/C10H19NO4/c1-7(2)9-11(4-5-14-9)8(3)6-15-10(12)13/h7-9H,4-6H2,1-3H3,(H,12,13)/p-1
InChIKeyUFGYAMMZYIWKDX-UHFFFAOYSA-M
XLogP0.05
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 50.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2-propan-2-yl-1,3-oxazolidin-3-yl) prop-2-enoate
CID 67923409
3-methyl-2-propan-2-yl-1,3-oxazolidine
CID 3039948
2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl N-(6-aminohexyl)-N-[2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethoxycarbonyl]carbamate
CID 18691697
2-morpholin-4-ylpropyl 2-methylpropanoate
CID 131966450
methyl 4-(4-aminobutan-2-yl)morpholine-2-carboxylate
CID 115533856
4-(1-methoxypropan-2-yl)-3,4a,5,6,7,7a-hexahydro-2H-pyrrolo[3,4-b][1,4]oxazine
CID 130892172
2,3,4-tri(propan-2-yl)morpholine
CID 166020055
4-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl)-2-methyl-2-(methylamino)pentanamide
CID 64709929
methyl 3-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-2-methylbutanoate
CID 79407124
2-methylpropyl 2-(2-methoxy-2-oxoethyl)morpholine-4-carboxylate
CID 113330714
2-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl)-3-methoxypropanoic acid
CID 103224698
4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83106165

Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate?
The IUPAC name of 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate (CID 57375900) is 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate.
What is the SMILES notation for 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate?
The canonical SMILES for 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate is CC(C)C1OCCN1C(C)COC(=O)[O-].
What is the InChIKey of 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate?
The InChIKey is UFGYAMMZYIWKDX-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H19NO4/c1-7(2)9-11(4-5-14-9)8(3)6-15-10(12)13/h7-9H,4-6H2,1-3H3,(H,12,13)/p-1.
What are the key properties of 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate?
2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate has a molecular weight of 216.26 g/mol, XLogP of 0.05, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)propyl carbonate is sourced from PubChem (CID 57375900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).