N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide

C17H19NO4 — CID 111107167

IUPACN-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide
SMILESCOc1cccc(C2CC2C(=O)NCC(O)c2ccco2)c1
InChIInChI=1S/C17H19NO4/c1-21-12-5-2-4-11(8-12)13-9-14(13)17(20)18-10-15(19)16-6-3-7-22-16/h2-8,13-15,19H,9-10H2,1H3,(H,18,20)
InChIKeyGGZMKEYPAORHEO-UHFFFAOYSA-N
MW301.34 g/mol
LogP2.24
Rot. Bonds6

About N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide

N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide (PubChem CID 111107167) has the molecular formula C17H19NO4 and a molecular weight of 301.34 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide
PubChem CID111107167
Molecular FormulaC17H19NO4
Molecular Weight301.34 g/mol
Exact Mass301.13
IUPAC NameN-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide
SMILESCOc1cccc(C2CC2C(=O)NCC(O)c2ccco2)c1
InChIInChI=1S/C17H19NO4/c1-21-12-5-2-4-11(8-12)13-9-14(13)17(20)18-10-15(19)16-6-3-7-22-16/h2-8,13-15,19H,9-10H2,1H3,(H,18,20)
InChIKeyGGZMKEYPAORHEO-UHFFFAOYSA-N
XLogP2.24
TPSA71.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.34
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide (CID 111107167) is N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide is COc1cccc(C2CC2C(=O)NCC(O)c2ccco2)c1.
What is the InChIKey of N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide?
The InChIKey is GGZMKEYPAORHEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO4/c1-21-12-5-2-4-11(8-12)13-9-14(13)17(20)18-10-15(19)16-6-3-7-22-16/h2-8,13-15,19H,9-10H2,1H3,(H,18,20).
What are the key properties of N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide?
N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide has a molecular weight of 301.34 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-hydroxyethyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 111107167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).