N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide

C23H25NO3 — CID 2938128

IUPACN-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide
SMILESCOc1ccccc1C(CCN(Cc1ccccc1)C(C)=O)c1ccco1
InChIInChI=1S/C23H25NO3/c1-18(25)24(17-19-9-4-3-5-10-19)15-14-21(23-13-8-16-27-23)20-11-6-7-12-22(20)26-2/h3-13,16,21H,14-15,17H2,1-2H3
InChIKeyLTDRKXAONKOYBC-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.86
Rot. Bonds8

About N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide

N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide (PubChem CID 2938128) has the molecular formula C23H25NO3 and a molecular weight of 363.46 g/mol. Its IUPAC name is N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide.

Molecular Properties

Compound NameN-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide
PubChem CID2938128
Molecular FormulaC23H25NO3
Molecular Weight363.46 g/mol
Exact Mass363.18
IUPAC NameN-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide
SMILESCOc1ccccc1C(CCN(Cc1ccccc1)C(C)=O)c1ccco1
InChIInChI=1S/C23H25NO3/c1-18(25)24(17-19-9-4-3-5-10-19)15-14-21(23-13-8-16-27-23)20-11-6-7-12-22(20)26-2/h3-13,16,21H,14-15,17H2,1-2H3
InChIKeyLTDRKXAONKOYBC-UHFFFAOYSA-N
XLogP4.86
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide?
The IUPAC name of N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide (CID 2938128) is N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide.
What is the SMILES notation for N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide?
The canonical SMILES for N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide is COc1ccccc1C(CCN(Cc1ccccc1)C(C)=O)c1ccco1.
What is the InChIKey of N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide?
The InChIKey is LTDRKXAONKOYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO3/c1-18(25)24(17-19-9-4-3-5-10-19)15-14-21(23-13-8-16-27-23)20-11-6-7-12-22(20)26-2/h3-13,16,21H,14-15,17H2,1-2H3.
What are the key properties of N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide?
N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide has a molecular weight of 363.46 g/mol, XLogP of 4.86, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]acetamide is sourced from PubChem (CID 2938128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).