N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide

C14H17FN4O2 — CID 43612145

IUPACN-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
SMILESCc1cc(CN(C)CC(=O)Nc2cc(F)ccc2N)no1
InChIInChI=1S/C14H17FN4O2/c1-9-5-11(18-21-9)7-19(2)8-14(20)17-13-6-10(15)3-4-12(13)16/h3-6H,7-8,16H2,1-2H3,(H,17,20)
InChIKeyQSRDZRZGRYQMKG-UHFFFAOYSA-N
MW292.31 g/mol
LogP1.77
Rot. Bonds5

About N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide

N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide (PubChem CID 43612145) has the molecular formula C14H17FN4O2 and a molecular weight of 292.31 g/mol. Its IUPAC name is N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
PubChem CID43612145
Molecular FormulaC14H17FN4O2
Molecular Weight292.31 g/mol
Exact Mass292.13
IUPAC NameN-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
SMILESCc1cc(CN(C)CC(=O)Nc2cc(F)ccc2N)no1
InChIInChI=1S/C14H17FN4O2/c1-9-5-11(18-21-9)7-19(2)8-14(20)17-13-6-10(15)3-4-12(13)16/h3-6H,7-8,16H2,1-2H3,(H,17,20)
InChIKeyQSRDZRZGRYQMKG-UHFFFAOYSA-N
XLogP1.77
TPSA84.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.31
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-5-fluorophenyl)-2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
CID 61426421
N-(2,5-dimethylphenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
CID 9321819
N-(2-amino-5-fluorophenyl)-2-[(5-chlorothiophen-2-yl)methyl-methylamino]acetamide
CID 61438327
N-(2-amino-5-fluorophenyl)-2-[methyl-[(1-methylimidazol-2-yl)methyl]amino]acetamide
CID 63014778
N-(2,3-dichlorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
CID 38877263
2-amino-4-fluoro-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 55137012
N-(5-fluoro-2-hydroxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 75433797
N-(2-amino-5-fluorophenyl)-2-[methyl-(1-methylpiperidin-4-yl)amino]acetamide
CID 43611892
2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]-N-(phenylcarbamoyl)acetamide
CID 36968374
2-[[2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetyl]amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 38878190
N-[1-(2,6-difluorophenyl)propan-2-yl]-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
CID 87016546
2-amino-N-(2-amino-5-fluorophenyl)acetamide
CID 110477650

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide?
The IUPAC name of N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide (CID 43612145) is N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide.
What is the SMILES notation for N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide?
The canonical SMILES for N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide is Cc1cc(CN(C)CC(=O)Nc2cc(F)ccc2N)no1.
What is the InChIKey of N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide?
The InChIKey is QSRDZRZGRYQMKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4O2/c1-9-5-11(18-21-9)7-19(2)8-14(20)17-13-6-10(15)3-4-12(13)16/h3-6H,7-8,16H2,1-2H3,(H,17,20).
What are the key properties of N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide?
N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide has a molecular weight of 292.31 g/mol, XLogP of 1.77, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-fluorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide is sourced from PubChem (CID 43612145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).