3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide

C15H14Cl2N2O4 — CID 9081404

IUPAC3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide
SMILESCOc1c(Cl)cc(C(=O)NCC(=O)NCc2ccco2)cc1Cl
InChIInChI=1S/C15H14Cl2N2O4/c1-22-14-11(16)5-9(6-12(14)17)15(21)19-8-13(20)18-7-10-3-2-4-23-10/h2-6H,7-8H2,1H3,(H,18,20)(H,19,21)
InChIKeyARQZPHTZWVOPSW-UHFFFAOYSA-N
MW357.19 g/mol
LogP2.64
Rot. Bonds6

About 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide

3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide (PubChem CID 9081404) has the molecular formula C15H14Cl2N2O4 and a molecular weight of 357.19 g/mol. Its IUPAC name is 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide.

Molecular Properties

Compound Name3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide
PubChem CID9081404
Molecular FormulaC15H14Cl2N2O4
Molecular Weight357.19 g/mol
Exact Mass356.03
IUPAC Name3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide
SMILESCOc1c(Cl)cc(C(=O)NCC(=O)NCc2ccco2)cc1Cl
InChIInChI=1S/C15H14Cl2N2O4/c1-22-14-11(16)5-9(6-12(14)17)15(21)19-8-13(20)18-7-10-3-2-4-23-10/h2-6H,7-8H2,1H3,(H,18,20)(H,19,21)
InChIKeyARQZPHTZWVOPSW-UHFFFAOYSA-N
XLogP2.64
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.19
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-[[3-(furan-2-ylmethylcarbamoyl)phenyl]methyl]-4,5-dimethoxybenzamide
CID 55876373
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 24517194
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2,3-dimethoxybenzamide
CID 34239119
N-[2-[[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]-2-oxoethyl]-3-methylbenzamide
CID 9079684
4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
CID 17395333
4-(2-amino-2-oxoethoxy)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-methoxybenzamide
CID 9081389
2-(2-chlorophenyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]acetamide
CID 24550973
2,3-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
CID 18118972
3-(3-chloro-4-methoxyphenyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]propanamide
CID 55512609
2-[(3,5-dichloro-4-methoxybenzoyl)amino]acetic acid
CID 43354480
4-chloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-1H-pyrrole-2-carboxamide
CID 18150991
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide
CID 18118956

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide?
The IUPAC name of 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide (CID 9081404) is 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide.
What is the SMILES notation for 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide?
The canonical SMILES for 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide is COc1c(Cl)cc(C(=O)NCC(=O)NCc2ccco2)cc1Cl.
What is the InChIKey of 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide?
The InChIKey is ARQZPHTZWVOPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O4/c1-22-14-11(16)5-9(6-12(14)17)15(21)19-8-13(20)18-7-10-3-2-4-23-10/h2-6H,7-8H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide?
3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide has a molecular weight of 357.19 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide is sourced from PubChem (CID 9081404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).