propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate

C11H21NO3 — CID 116654581

IUPACpropan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate
SMILESCCN(CC1CCCO1)C(=O)OC(C)C
InChIInChI=1S/C11H21NO3/c1-4-12(11(13)15-9(2)3)8-10-6-5-7-14-10/h9-10H,4-8H2,1-3H3
InChIKeyURGVXHFIOUDBBR-UHFFFAOYSA-N
MW215.29 g/mol
LogP2.03
Rot. Bonds4

About propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate

propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate (PubChem CID 116654581) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate.

Molecular Properties

Compound Namepropan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate
PubChem CID116654581
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Namepropan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate
SMILESCCN(CC1CCCO1)C(=O)OC(C)C
InChIInChI=1S/C11H21NO3/c1-4-12(11(13)15-9(2)3)8-10-6-5-7-14-10/h9-10H,4-8H2,1-3H3
InChIKeyURGVXHFIOUDBBR-UHFFFAOYSA-N
XLogP2.03
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl (2S)-2-fluoro-2-(methoxymethyl)pyrrolidine-1-carboxylate
CID 66592318
Ethyl 2-(methoxymethyl)pyrrolidine-1-carboxylate
CID 45120189
2,2,2-trifluoroethyl N,N-bis(oxolan-2-ylmethyl)carbamate
CID 61068657
2,2,2-trifluoroethyl N-methyl-N-(oxolan-2-ylmethyl)carbamate
CID 61238690
2,2,2-trifluoroethyl N-ethyl-N-(oxolan-2-ylmethyl)carbamate
CID 61355732
tert-butyl (2S)-2-(2-fluoroethoxymethyl)pyrrolidine-1-carboxylate
CID 130754657
Wabneichbrbocm-uhfffaoysa-
CID 11265004
(1-methylpyrrolidin-2-yl)methyl N,N-dimethylcarbamate
CID 10511771
[(2S)-1-methylpyrrolidin-2-yl]methyl N,N-dimethylcarbamate
CID 10607599
3-(1-Butoxyethyl)-5-methyl-1,3-oxazolidin-2-one
CID 20043086
5-Ethyl-3-(1-propoxyethyl)-1,3-oxazolidin-2-one
CID 20043094
5-Ethyl-3-(1-propan-2-yloxyethyl)-1,3-oxazolidin-2-one
CID 20043098

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate?
The IUPAC name of propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate (CID 116654581) is propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate.
What is the SMILES notation for propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate?
The canonical SMILES for propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate is CCN(CC1CCCO1)C(=O)OC(C)C.
What is the InChIKey of propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate?
The InChIKey is URGVXHFIOUDBBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-4-12(11(13)15-9(2)3)8-10-6-5-7-14-10/h9-10H,4-8H2,1-3H3.
What are the key properties of propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate?
propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate has a molecular weight of 215.29 g/mol, XLogP of 2.03, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-ethyl-N-(oxolan-2-ylmethyl)carbamate is sourced from PubChem (CID 116654581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).