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

C11H17NO3 — CID 116654523

IUPACpropan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate
SMILESCCN(Cc1ccco1)C(=O)OC(C)C
InChIInChI=1S/C11H17NO3/c1-4-12(11(13)15-9(2)3)8-10-6-5-7-14-10/h5-7,9H,4,8H2,1-3H3
InChIKeyVRVUSEAIJLJCEW-UHFFFAOYSA-N
MW211.26 g/mol
LogP2.65
Rot. Bonds4

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

propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate (PubChem CID 116654523) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate.

Molecular Properties

Compound Namepropan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate
PubChem CID116654523
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Namepropan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate
SMILESCCN(Cc1ccco1)C(=O)OC(C)C
InChIInChI=1S/C11H17NO3/c1-4-12(11(13)15-9(2)3)8-10-6-5-7-14-10/h5-7,9H,4,8H2,1-3H3
InChIKeyVRVUSEAIJLJCEW-UHFFFAOYSA-N
XLogP2.65
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(furan-2-ylmethyl)-2-sulfanylpropanamide
CID 107024393
1-ethyl-1-(furan-2-ylmethyl)-3,3-dimethylurea
CID 115581572
N,N-bis(furan-2-ylmethyl)-2-propan-2-yloxyacetamide
CID 115593503
3-[ethyl-[ethyl(furan-2-ylmethyl)carbamoyl]amino]-2-methylpropanoic acid
CID 62853925
N-ethyl-N-(furan-2-ylmethyl)-2-hydroxy-2-methylpropanamide
CID 103429605
2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide
CID 60938301
2-(butan-2-ylamino)-N-ethyl-N-(furan-2-ylmethyl)acetamide
CID 60946987
N-ethyl-N-(furan-2-ylmethyl)but-2-enamide
CID 112727369
(2R)-2-amino-N-ethyl-N-(furan-2-ylmethyl)pentanamide
CID 107568950
methyl N-(furan-2-ylmethyl)-N-methylcarbamate
CID 2755161
N,N-bis(furan-2-ylmethyl)-2-methoxy-2-methylpropanamide
CID 103029007
3-amino-5-ethoxy-N-ethyl-N-(furan-2-ylmethyl)benzamide
CID 81093317

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate?
The IUPAC name of propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate (CID 116654523) is propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate.
What is the SMILES notation for propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate?
The canonical SMILES for propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate is CCN(Cc1ccco1)C(=O)OC(C)C.
What is the InChIKey of propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate?
The InChIKey is VRVUSEAIJLJCEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-4-12(11(13)15-9(2)3)8-10-6-5-7-14-10/h5-7,9H,4,8H2,1-3H3.
What are the key properties of propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate?
propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate has a molecular weight of 211.26 g/mol, XLogP of 2.65, 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-(furan-2-ylmethyl)carbamate is sourced from PubChem (CID 116654523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).