2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide

C18H15Cl2NO3 — CID 112767070

IUPAC2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1ccco1)Cc1ccco1
InChIInChI=1S/C18H15Cl2NO3/c19-16-6-5-13(9-17(16)20)10-18(22)21(11-14-3-1-7-23-14)12-15-4-2-8-24-15/h1-9H,10-12H2
InChIKeySWLYXEXTQWRCQM-UHFFFAOYSA-N
MW364.23 g/mol
LogP4.95
Rot. Bonds6

About 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide

2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide (PubChem CID 112767070) has the molecular formula C18H15Cl2NO3 and a molecular weight of 364.23 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide
PubChem CID112767070
Molecular FormulaC18H15Cl2NO3
Molecular Weight364.23 g/mol
Exact Mass363.04
IUPAC Name2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1ccco1)Cc1ccco1
InChIInChI=1S/C18H15Cl2NO3/c19-16-6-5-13(9-17(16)20)10-18(22)21(11-14-3-1-7-23-14)12-15-4-2-8-24-15/h1-9H,10-12H2
InChIKeySWLYXEXTQWRCQM-UHFFFAOYSA-N
XLogP4.95
TPSA46.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.23
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-dichlorophenyl)-3-(furan-2-yl)propan-2-one
CID 83172334
N,N-bis(furan-2-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 52548109
2-(2-chlorophenyl)-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)acetamide
CID 121084664
N-(furan-2-ylmethyl)-N-[(2-hydroxyphenyl)methyl]-2-(3-methoxy-4-methylphenyl)acetamide
CID 78828421
2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)acetamide
CID 51130616
1-(3,4-dichlorophenyl)-2-(furan-2-yl)ethanone
CID 83172219
2-(3,4-dichlorophenyl)-N,N-dimethylacetamide
CID 14740023
2-(2-chlorophenyl)sulfanyl-N,N-bis(furan-2-ylmethyl)acetamide
CID 55340134
N-cyclopropyl-4-[[[2-(3,4-dichlorophenoxy)acetyl]-(furan-2-ylmethyl)amino]methyl]benzamide
CID 112818770
N-[(4-chlorophenyl)methyl]-2-(5-ethyl-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide
CID 18861228
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-3,4-dichloro-N-(2-methoxyethyl)benzamide
CID 5055169
2-chloro-N,N-bis(furan-2-ylmethyl)furan-3-carboxamide
CID 106686174

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide (CID 112767070) is 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide is O=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1ccco1)Cc1ccco1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide?
The InChIKey is SWLYXEXTQWRCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2NO3/c19-16-6-5-13(9-17(16)20)10-18(22)21(11-14-3-1-7-23-14)12-15-4-2-8-24-15/h1-9H,10-12H2.
What are the key properties of 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide?
2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide has a molecular weight of 364.23 g/mol, XLogP of 4.95, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N,N-bis(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 112767070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).