2-amino-N-[(2,3-difluorophenyl)methyl]acetamide

C9H10F2N2O — CID 82670923

IUPAC2-amino-N-[(2,3-difluorophenyl)methyl]acetamide
SMILESNCC(=O)NCc1cccc(F)c1F
InChIInChI=1S/C9H10F2N2O/c10-7-3-1-2-6(9(7)11)5-13-8(14)4-12/h1-3H,4-5,12H2,(H,13,14)
InChIKeyHNNPDMAOAJWWIW-UHFFFAOYSA-N
MW200.19 g/mol
LogP0.54
Rot. Bonds3

About 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide

2-amino-N-[(2,3-difluorophenyl)methyl]acetamide (PubChem CID 82670923) has the molecular formula C9H10F2N2O and a molecular weight of 200.19 g/mol. Its IUPAC name is 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[(2,3-difluorophenyl)methyl]acetamide
PubChem CID82670923
Molecular FormulaC9H10F2N2O
Molecular Weight200.19 g/mol
Exact Mass200.08
IUPAC Name2-amino-N-[(2,3-difluorophenyl)methyl]acetamide
SMILESNCC(=O)NCc1cccc(F)c1F
InChIInChI=1S/C9H10F2N2O/c10-7-3-1-2-6(9(7)11)5-13-8(14)4-12/h1-3H,4-5,12H2,(H,13,14)
InChIKeyHNNPDMAOAJWWIW-UHFFFAOYSA-N
XLogP0.54
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-difluorophenyl)-N-[(2-hydroxyphenyl)methyl]acetamide
CID 115687726
2-amino-N-[[1-[(2,3-difluorophenyl)methyl]triazol-4-yl]methyl]acetamide
CID 114778664
2-amino-N-[(2,6-difluorophenyl)methyl]acetamide;hydrochloride
CID 130684116
2-amino-N-(naphthalen-1-ylmethyl)acetamide
CID 62369786
N-[(E)-4-aminobut-2-enyl]-2-(2,3-difluorophenyl)acetamide
CID 113414811
4-amino-1-(2,3-difluorophenyl)butan-2-one
CID 116550836
(2,3-difluorophenyl)methanamine
CID 2736941
N-[[3-(bromomethyl)phenyl]methyl]-2-(2,3-difluorophenyl)acetamide
CID 114313198
N-(2-bromoprop-2-enyl)-2-(2,3-difluorophenyl)acetamide
CID 115686682
6-amino-N-[(2,3,4-trifluorophenyl)methyl]hexanamide
CID 110482622
2-amino-N-[2-(2,3,4-trifluorophenyl)ethyl]acetamide
CID 110477577
2-(2,3-difluorophenyl)acetic acid;hydrochloride
CID 172702403

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide?
The IUPAC name of 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide (CID 82670923) is 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide.
What is the SMILES notation for 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide?
The canonical SMILES for 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide is NCC(=O)NCc1cccc(F)c1F.
What is the InChIKey of 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide?
The InChIKey is HNNPDMAOAJWWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O/c10-7-3-1-2-6(9(7)11)5-13-8(14)4-12/h1-3H,4-5,12H2,(H,13,14).
What are the key properties of 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide?
2-amino-N-[(2,3-difluorophenyl)methyl]acetamide has a molecular weight of 200.19 g/mol, XLogP of 0.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2,3-difluorophenyl)methyl]acetamide is sourced from PubChem (CID 82670923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).