N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide

C17H18F2N4O3 — CID 53175069

IUPACN-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide
SMILESCCNC(=O)Nc1ccc(OCC(=O)NCc2ccc(F)cc2F)nc1
InChIInChI=1S/C17H18F2N4O3/c1-2-20-17(25)23-13-5-6-16(22-9-13)26-10-15(24)21-8-11-3-4-12(18)7-14(11)19/h3-7,9H,2,8,10H2,1H3,(H,21,24)(H2,20,23,25)
InChIKeyUATKDUJRGRWGLE-UHFFFAOYSA-N
MW364.35 g/mol
LogP2.20
Rot. Bonds7

About N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide

N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide (PubChem CID 53175069) has the molecular formula C17H18F2N4O3 and a molecular weight of 364.35 g/mol. Its IUPAC name is N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide.

Molecular Properties

Compound NameN-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide
PubChem CID53175069
Molecular FormulaC17H18F2N4O3
Molecular Weight364.35 g/mol
Exact Mass364.13
IUPAC NameN-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide
SMILESCCNC(=O)Nc1ccc(OCC(=O)NCc2ccc(F)cc2F)nc1
InChIInChI=1S/C17H18F2N4O3/c1-2-20-17(25)23-13-5-6-16(22-9-13)26-10-15(24)21-8-11-3-4-12(18)7-14(11)19/h3-7,9H,2,8,10H2,1H3,(H,21,24)(H2,20,23,25)
InChIKeyUATKDUJRGRWGLE-UHFFFAOYSA-N
XLogP2.20
TPSA92.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.35
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide?
The IUPAC name of N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide (CID 53175069) is N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide.
What is the SMILES notation for N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide?
The canonical SMILES for N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide is CCNC(=O)Nc1ccc(OCC(=O)NCc2ccc(F)cc2F)nc1.
What is the InChIKey of N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide?
The InChIKey is UATKDUJRGRWGLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2N4O3/c1-2-20-17(25)23-13-5-6-16(22-9-13)26-10-15(24)21-8-11-3-4-12(18)7-14(11)19/h3-7,9H,2,8,10H2,1H3,(H,21,24)(H2,20,23,25).
What are the key properties of N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide?
N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide has a molecular weight of 364.35 g/mol, XLogP of 2.20, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-difluorophenyl)methyl]-2-[[5-(ethylcarbamoylamino)-2-pyridinyl]oxy]acetamide is sourced from PubChem (CID 53175069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).