N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide

C22H22FNO4 — CID 86832598

IUPACN-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide
SMILESCOc1ccccc1OCc1ccc(C(=O)N(C)CCc2ccc(F)cc2)o1
InChIInChI=1S/C22H22FNO4/c1-24(14-13-16-7-9-17(23)10-8-16)22(25)21-12-11-18(28-21)15-27-20-6-4-3-5-19(20)26-2/h3-12H,13-15H2,1-2H3
InChIKeyUKHBCLNXDDHBER-UHFFFAOYSA-N
MW383.42 g/mol
LogP4.32
Rot. Bonds8

About N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide

N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide (PubChem CID 86832598) has the molecular formula C22H22FNO4 and a molecular weight of 383.42 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide
PubChem CID86832598
Molecular FormulaC22H22FNO4
Molecular Weight383.42 g/mol
Exact Mass383.15
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide
SMILESCOc1ccccc1OCc1ccc(C(=O)N(C)CCc2ccc(F)cc2)o1
InChIInChI=1S/C22H22FNO4/c1-24(14-13-16-7-9-17(23)10-8-16)22(25)21-12-11-18(28-21)15-27-20-6-4-3-5-19(20)26-2/h3-12H,13-15H2,1-2H3
InChIKeyUKHBCLNXDDHBER-UHFFFAOYSA-N
XLogP4.32
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.42
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(2-methoxyphenoxy)methyl]-N-methyl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 87002082
N-benzyl-5-[(4-fluorophenoxy)methyl]-N-methylfuran-2-carboxamide
CID 51147848
5-[(4-fluorophenoxy)methyl]-N-(3-hydroxybutyl)-N-methylfuran-2-carboxamide
CID 111695820
N-[2-(4-fluorophenyl)ethyl]-2,3,4-trimethoxy-N-methylbenzamide
CID 60571717
5-[(2-methoxyphenoxy)methyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 717010
N-[(2-bromophenyl)methyl]-5-[(4-fluorophenoxy)methyl]-N-methylfuran-2-carboxamide
CID 31215377
5-[(4-fluorophenoxy)methyl]-N-(2-hydroxy-2-methylpropyl)-N-methylfuran-2-carboxamide
CID 111579452
1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene
CID 957472
N-[2-(ethylamino)-2-oxoethyl]-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 86997976
[5-[(2-methoxyphenoxy)methyl]furan-2-yl]-piperidin-1-ylmethanone
CID 1084341
N-(cyclopropylmethyl)-N-methyl-5-[(2-methylphenoxy)methyl]furan-2-carboxamide
CID 95748480
propan-2-yl 3-[[5-[(2-methoxyphenoxy)methyl]furan-2-carbonyl]amino]propanoate
CID 55788987

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide (CID 86832598) is N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide is COc1ccccc1OCc1ccc(C(=O)N(C)CCc2ccc(F)cc2)o1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide?
The InChIKey is UKHBCLNXDDHBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22FNO4/c1-24(14-13-16-7-9-17(23)10-8-16)22(25)21-12-11-18(28-21)15-27-20-6-4-3-5-19(20)26-2/h3-12H,13-15H2,1-2H3.
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide?
N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide has a molecular weight of 383.42 g/mol, XLogP of 4.32, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-5-[(2-methoxyphenoxy)methyl]-N-methylfuran-2-carboxamide is sourced from PubChem (CID 86832598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).