N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide

C22H23NO4 — CID 42959591

IUPACN-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide
SMILESCOc1ccc(C(O)CNC(=O)CCc2ccc(-c3ccccc3)o2)cc1
InChIInChI=1S/C22H23NO4/c1-26-18-9-7-16(8-10-18)20(24)15-23-22(25)14-12-19-11-13-21(27-19)17-5-3-2-4-6-17/h2-11,13,20,24H,12,14-15H2,1H3,(H,23,25)
InChIKeyDMJNOQFFUXZXOU-UHFFFAOYSA-N
MW365.43 g/mol
LogP3.74
Rot. Bonds8

About N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide

N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide (PubChem CID 42959591) has the molecular formula C22H23NO4 and a molecular weight of 365.43 g/mol. Its IUPAC name is N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide.

Molecular Properties

Compound NameN-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide
PubChem CID42959591
Molecular FormulaC22H23NO4
Molecular Weight365.43 g/mol
Exact Mass365.16
IUPAC NameN-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide
SMILESCOc1ccc(C(O)CNC(=O)CCc2ccc(-c3ccccc3)o2)cc1
InChIInChI=1S/C22H23NO4/c1-26-18-9-7-16(8-10-18)20(24)15-23-22(25)14-12-19-11-13-21(27-19)17-5-3-2-4-6-17/h2-11,13,20,24H,12,14-15H2,1H3,(H,23,25)
InChIKeyDMJNOQFFUXZXOU-UHFFFAOYSA-N
XLogP3.74
TPSA71.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide
CID 18127068
3-(5-phenylfuran-2-yl)-N-(2-phenylpropyl)propanamide
CID 42907748
3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide
CID 22587421
N-[2-(4-tert-butylphenyl)-2-hydroxyethyl]-3-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]propanamide
CID 86962574
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-4-methyl-4-phenylpentanamide
CID 109380164
3-(5-phenylfuran-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide
CID 9483404
N-(4-hydroxy-2,2-dimethylpentyl)-3-(5-phenylfuran-2-yl)propanamide
CID 111480285
N-[(2,5-dimethoxyphenyl)methyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 33113653
N-(3-phenoxypropyl)-3-(5-phenylfuran-2-yl)propanamide
CID 18120278
N-(2-methyl-3-piperidin-1-ylpropyl)-3-(5-phenylfuran-2-yl)propanamide
CID 55980917
3-[5-(4-methoxyphenyl)furan-2-yl]-N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]propanamide
CID 26010955
4-amino-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]butanamide;hydrochloride
CID 119293246

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide?
The IUPAC name of N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide (CID 42959591) is N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide.
What is the SMILES notation for N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide?
The canonical SMILES for N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide is COc1ccc(C(O)CNC(=O)CCc2ccc(-c3ccccc3)o2)cc1.
What is the InChIKey of N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide?
The InChIKey is DMJNOQFFUXZXOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO4/c1-26-18-9-7-16(8-10-18)20(24)15-23-22(25)14-12-19-11-13-21(27-19)17-5-3-2-4-6-17/h2-11,13,20,24H,12,14-15H2,1H3,(H,23,25).
What are the key properties of N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide?
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide has a molecular weight of 365.43 g/mol, XLogP of 3.74, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide is sourced from PubChem (CID 42959591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).