N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide

C15H15F2N3O — CID 43408879

IUPACN-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide
SMILESCC(NCC(=O)Nc1c(F)cccc1F)c1ccncc1
InChIInChI=1S/C15H15F2N3O/c1-10(11-5-7-18-8-6-11)19-9-14(21)20-15-12(16)3-2-4-13(15)17/h2-8,10,19H,9H2,1H3,(H,20,21)
InChIKeyMOJSCARYKOGYCY-UHFFFAOYSA-N
MW291.30 g/mol
LogP2.65
Rot. Bonds5

About N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide

N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide (PubChem CID 43408879) has the molecular formula C15H15F2N3O and a molecular weight of 291.30 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide
PubChem CID43408879
Molecular FormulaC15H15F2N3O
Molecular Weight291.30 g/mol
Exact Mass291.12
IUPAC NameN-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide
SMILESCC(NCC(=O)Nc1c(F)cccc1F)c1ccncc1
InChIInChI=1S/C15H15F2N3O/c1-10(11-5-7-18-8-6-11)19-9-14(21)20-15-12(16)3-2-4-13(15)17/h2-8,10,19H,9H2,1H3,(H,20,21)
InChIKeyMOJSCARYKOGYCY-UHFFFAOYSA-N
XLogP2.65
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylphenyl)-2-[[(1R)-1-pyridin-4-ylethyl]amino]acetamide
CID 81409885
N-(4-chlorophenyl)-2-[[(1R)-1-pyridin-4-ylethyl]amino]acetamide
CID 81410060
N-(2,6-difluorophenyl)-2-[[(1R)-1-(2,4-difluorophenyl)ethyl]amino]acetamide
CID 9369757
N-ethyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]acetamide
CID 81409863
N-(2,6-dichlorophenyl)-2-[[(1S)-1-(3,4-difluorophenyl)ethyl]amino]acetamide
CID 9376760
N-carbamoyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]acetamide
CID 81410117
N-pentan-2-yl-2-(1-pyridin-4-ylethylamino)acetamide
CID 60693847
2-(1-pyridin-4-ylethylamino)acetamide
CID 16775752
N-[(2-fluorophenyl)methyl]-1-pyridin-4-ylethanamine
CID 43178816
N-[2,6-di(propan-2-yl)phenyl]-2-(1-phenylethylamino)acetamide
CID 4877514
N-(2,6-difluorophenyl)-2-(heptan-2-ylamino)acetamide
CID 60688234
N-(2,6-difluorophenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392689

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide (CID 43408879) is N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide is CC(NCC(=O)Nc1c(F)cccc1F)c1ccncc1.
What is the InChIKey of N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide?
The InChIKey is MOJSCARYKOGYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N3O/c1-10(11-5-7-18-8-6-11)19-9-14(21)20-15-12(16)3-2-4-13(15)17/h2-8,10,19H,9H2,1H3,(H,20,21).
What are the key properties of N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide?
N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide has a molecular weight of 291.30 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-(1-pyridin-4-ylethylamino)acetamide is sourced from PubChem (CID 43408879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).