2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide

C20H17ClN2O4 — CID 1317725

IUPAC2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
SMILESO=C(COc1ccc(Cl)cc1)Nc1ccccc1C(=O)NCc1ccco1
InChIInChI=1S/C20H17ClN2O4/c21-14-7-9-15(10-8-14)27-13-19(24)23-18-6-2-1-5-17(18)20(25)22-12-16-4-3-11-26-16/h1-11H,12-13H2,(H,22,25)(H,23,24)
InChIKeyNLVPUAFYVYULHA-UHFFFAOYSA-N
MW384.82 g/mol
LogP3.88
Rot. Bonds7

About 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide

2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide (PubChem CID 1317725) has the molecular formula C20H17ClN2O4 and a molecular weight of 384.82 g/mol. Its IUPAC name is 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
PubChem CID1317725
Molecular FormulaC20H17ClN2O4
Molecular Weight384.82 g/mol
Exact Mass384.09
IUPAC Name2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
SMILESO=C(COc1ccc(Cl)cc1)Nc1ccccc1C(=O)NCc1ccco1
InChIInChI=1S/C20H17ClN2O4/c21-14-7-9-15(10-8-14)27-13-19(24)23-18-6-2-1-5-17(18)20(25)22-12-16-4-3-11-26-16/h1-11H,12-13H2,(H,22,25)(H,23,24)
InChIKeyNLVPUAFYVYULHA-UHFFFAOYSA-N
XLogP3.88
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.82
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide (CID 1317725) is 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide is O=C(COc1ccc(Cl)cc1)Nc1ccccc1C(=O)NCc1ccco1.
What is the InChIKey of 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The InChIKey is NLVPUAFYVYULHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4/c21-14-7-9-15(10-8-14)27-13-19(24)23-18-6-2-1-5-17(18)20(25)22-12-16-4-3-11-26-16/h1-11H,12-13H2,(H,22,25)(H,23,24).
What are the key properties of 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide has a molecular weight of 384.82 g/mol, XLogP of 3.88, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-chlorophenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 1317725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).