N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide

C21H21N3O5 — CID 55527410

IUPACN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1
InChIInChI=1S/C21H21N3O5/c1-27-18-6-2-3-7-19(18)29-14-20(25)23-15-8-10-16(11-9-15)24-21(26)22-13-17-5-4-12-28-17/h2-12H,13-14H2,1H3,(H,23,25)(H2,22,24,26)
InChIKeyCTLATLARMZTIQU-UHFFFAOYSA-N
MW395.42 g/mol
LogP3.63
Rot. Bonds8

About N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide

N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide (PubChem CID 55527410) has the molecular formula C21H21N3O5 and a molecular weight of 395.42 g/mol. Its IUPAC name is N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide
PubChem CID55527410
Molecular FormulaC21H21N3O5
Molecular Weight395.42 g/mol
Exact Mass395.15
IUPAC NameN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1
InChIInChI=1S/C21H21N3O5/c1-27-18-6-2-3-7-19(18)29-14-20(25)23-15-8-10-16(11-9-15)24-21(26)22-13-17-5-4-12-28-17/h2-12H,13-14H2,1H3,(H,23,25)(H2,22,24,26)
InChIKeyCTLATLARMZTIQU-UHFFFAOYSA-N
XLogP3.63
TPSA101.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.42
LogP ≤ 53.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-3-methoxy-4-methylbenzamide
CID 35338148
4-[[2-(2-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 28638354
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
2-(4-fluorophenyl)-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]acetamide
CID 35335065
2-(2-methoxyphenoxy)-N-[4-[(2-methoxyphenyl)methylamino]phenyl]acetamide
CID 112982660
2-(2-methoxyphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 2677021
N-(furan-2-ylmethyl)-N'-[(Z)-[3-methoxy-4-[2-(3-methoxyanilino)-2-oxoethoxy]phenyl]methylideneamino]oxamide
CID 126258731
N-(2-benzamidoethyl)-4-[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
CID 121063227
N-[4-(4-acetylanilino)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 112988234
2-(2-methoxyphenoxy)-N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 25284211
3-[[2-(2-butan-2-ylphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 17199877
5-[[2-(2-methoxyphenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid
CID 880340

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide (CID 55527410) is N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1.
What is the InChIKey of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide?
The InChIKey is CTLATLARMZTIQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O5/c1-27-18-6-2-3-7-19(18)29-14-20(25)23-15-8-10-16(11-9-15)24-21(26)22-13-17-5-4-12-28-17/h2-12H,13-14H2,1H3,(H,23,25)(H2,22,24,26).
What are the key properties of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide?
N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide has a molecular weight of 395.42 g/mol, XLogP of 3.63, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 55527410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).