N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C13H19NO2 — CID 652125

IUPACN-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NCc2ccco2)C1(C)C
InChIInChI=1S/C13H19NO2/c1-12(2)10(13(12,3)4)11(15)14-8-9-6-5-7-16-9/h5-7,10H,8H2,1-4H3,(H,14,15)
InChIKeyOWQBKSNEDAEYBI-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.58
Rot. Bonds3

About N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 652125) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID652125
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NCc2ccco2)C1(C)C
InChIInChI=1S/C13H19NO2/c1-12(2)10(13(12,3)4)11(15)14-8-9-6-5-7-16-9/h5-7,10H,8H2,1-4H3,(H,14,15)
InChIKeyOWQBKSNEDAEYBI-UHFFFAOYSA-N
XLogP2.58
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 652125) is N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC1(C)C(C(=O)NCc2ccco2)C1(C)C.
What is the InChIKey of N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is OWQBKSNEDAEYBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-12(2)10(13(12,3)4)11(15)14-8-9-6-5-7-16-9/h5-7,10H,8H2,1-4H3,(H,14,15).
What are the key properties of N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 652125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).