2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide

C17H19NO3 — CID 86851473

IUPAC2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide
SMILESCOc1ccc(CCNC(=O)C2CC2c2ccco2)cc1
InChIInChI=1S/C17H19NO3/c1-20-13-6-4-12(5-7-13)8-9-18-17(19)15-11-14(15)16-3-2-10-21-16/h2-7,10,14-15H,8-9,11H2,1H3,(H,18,19)
InChIKeyFBWQQIDYLBKUTM-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.75
Rot. Bonds6

About 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide

2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide (PubChem CID 86851473) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide
PubChem CID86851473
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide
SMILESCOc1ccc(CCNC(=O)C2CC2c2ccco2)cc1
InChIInChI=1S/C17H19NO3/c1-20-13-6-4-12(5-7-13)8-9-18-17(19)15-11-14(15)16-3-2-10-21-16/h2-7,10,14-15H,8-9,11H2,1H3,(H,18,19)
InChIKeyFBWQQIDYLBKUTM-UHFFFAOYSA-N
XLogP2.75
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide (CID 86851473) is 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide is COc1ccc(CCNC(=O)C2CC2c2ccco2)cc1.
What is the InChIKey of 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide?
The InChIKey is FBWQQIDYLBKUTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-20-13-6-4-12(5-7-13)8-9-18-17(19)15-11-14(15)16-3-2-10-21-16/h2-7,10,14-15H,8-9,11H2,1H3,(H,18,19).
What are the key properties of 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide?
2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide has a molecular weight of 285.34 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 86851473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).