N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide

C22H22N2O4 — CID 51283919

IUPACN-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide
SMILESCOc1ccccc1CCC(=O)Nc1ccccc1C(=O)NCc1ccco1
InChIInChI=1S/C22H22N2O4/c1-27-20-11-5-2-7-16(20)12-13-21(25)24-19-10-4-3-9-18(19)22(26)23-15-17-8-6-14-28-17/h2-11,14H,12-13,15H2,1H3,(H,23,26)(H,24,25)
InChIKeyCUFGFFPDGKSGJY-UHFFFAOYSA-N
MW378.43 g/mol
LogP3.79
Rot. Bonds8

About N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide

N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide (PubChem CID 51283919) has the molecular formula C22H22N2O4 and a molecular weight of 378.43 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide
PubChem CID51283919
Molecular FormulaC22H22N2O4
Molecular Weight378.43 g/mol
Exact Mass378.16
IUPAC NameN-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide
SMILESCOc1ccccc1CCC(=O)Nc1ccccc1C(=O)NCc1ccco1
InChIInChI=1S/C22H22N2O4/c1-27-20-11-5-2-7-16(20)12-13-21(25)24-19-10-4-3-9-18(19)22(26)23-15-17-8-6-14-28-17/h2-11,14H,12-13,15H2,1H3,(H,23,26)(H,24,25)
InChIKeyCUFGFFPDGKSGJY-UHFFFAOYSA-N
XLogP3.79
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-2-[3-(3,4,5-trimethoxyphenyl)propanoylamino]benzamide
CID 34646854
N-(furan-2-ylmethyl)-2-[3-(4-methoxyphenyl)propanoylamino]benzamide
CID 51188549
2-methoxyethyl 4-[2-(furan-2-ylmethylcarbamoyl)anilino]-4-oxobutanoate
CID 17339123
N,N'-bis[2-(furan-2-ylmethylcarbamoyl)phenyl]hexanediamide
CID 4938791
N-(furan-2-ylmethyl)-2-[3-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)propanoylamino]benzamide
CID 100774905
N-(furan-2-ylmethyl)-2-(heptanoylamino)benzamide
CID 36859009
methyl 2-[3-(2-methoxyphenyl)propanoylamino]benzoate
CID 17360384
2-[(2-bromoacetyl)amino]-N-(furan-2-ylmethyl)benzamide
CID 112547104
N,3-bis(2-methoxyphenyl)propanamide
CID 17394407
N-(furan-2-ylmethyl)-2-[(2-methoxyphenyl)sulfonylamino]benzamide
CID 51170390
N-(furan-2-ylmethyl)-2-[[2-(2-propan-2-ylphenoxy)acetyl]amino]benzamide
CID 4938414
N-(furan-2-ylmethyl)-2-[[2-(3-methoxyphenoxy)acetyl]amino]benzamide
CID 94878119

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide (CID 51283919) is N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide is COc1ccccc1CCC(=O)Nc1ccccc1C(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide?
The InChIKey is CUFGFFPDGKSGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4/c1-27-20-11-5-2-7-16(20)12-13-21(25)24-19-10-4-3-9-18(19)22(26)23-15-17-8-6-14-28-17/h2-11,14H,12-13,15H2,1H3,(H,23,26)(H,24,25).
What are the key properties of N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide?
N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide has a molecular weight of 378.43 g/mol, XLogP of 3.79, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[3-(2-methoxyphenyl)propanoylamino]benzamide is sourced from PubChem (CID 51283919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).