2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide

C15H16ClNO2 — CID 56765552

IUPAC2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide
SMILESCc1cc(CNC(=O)Cc2ccccc2Cl)c(C)o1
InChIInChI=1S/C15H16ClNO2/c1-10-7-13(11(2)19-10)9-17-15(18)8-12-5-3-4-6-14(12)16/h3-7H,8-9H2,1-2H3,(H,17,18)
InChIKeyCMZWONSIPWSYJE-UHFFFAOYSA-N
MW277.75 g/mol
LogP3.41
Rot. Bonds4

About 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide

2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide (PubChem CID 56765552) has the molecular formula C15H16ClNO2 and a molecular weight of 277.75 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide
PubChem CID56765552
Molecular FormulaC15H16ClNO2
Molecular Weight277.75 g/mol
Exact Mass277.09
IUPAC Name2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide
SMILESCc1cc(CNC(=O)Cc2ccccc2Cl)c(C)o1
InChIInChI=1S/C15H16ClNO2/c1-10-7-13(11(2)19-10)9-17-15(18)8-12-5-3-4-6-14(12)16/h3-7H,8-9H2,1-2H3,(H,17,18)
InChIKeyCMZWONSIPWSYJE-UHFFFAOYSA-N
XLogP3.41
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.75
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide (CID 56765552) is 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide is Cc1cc(CNC(=O)Cc2ccccc2Cl)c(C)o1.
What is the InChIKey of 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide?
The InChIKey is CMZWONSIPWSYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO2/c1-10-7-13(11(2)19-10)9-17-15(18)8-12-5-3-4-6-14(12)16/h3-7H,8-9H2,1-2H3,(H,17,18).
What are the key properties of 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide?
2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide has a molecular weight of 277.75 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[(2,5-dimethylfuran-3-yl)methyl]acetamide is sourced from PubChem (CID 56765552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).