N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide

C13H12FN3O2 — CID 102881864

IUPACN-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(N)cn2)c(F)c1
InChIInChI=1S/C13H12FN3O2/c1-19-9-3-4-10(11(14)6-9)13(18)17-12-5-2-8(15)7-16-12/h2-7H,15H2,1H3,(H,16,17,18)
InChIKeyOZTOUQAHNBPMIE-UHFFFAOYSA-N
MW261.26 g/mol
LogP2.06
Rot. Bonds3

About N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide

N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide (PubChem CID 102881864) has the molecular formula C13H12FN3O2 and a molecular weight of 261.26 g/mol. Its IUPAC name is N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide.

Molecular Properties

Compound NameN-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide
PubChem CID102881864
Molecular FormulaC13H12FN3O2
Molecular Weight261.26 g/mol
Exact Mass261.09
IUPAC NameN-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(N)cn2)c(F)c1
InChIInChI=1S/C13H12FN3O2/c1-19-9-3-4-10(11(14)6-9)13(18)17-12-5-2-8(15)7-16-12/h2-7H,15H2,1H3,(H,16,17,18)
InChIKeyOZTOUQAHNBPMIE-UHFFFAOYSA-N
XLogP2.06
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.26
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2-fluoro-4-methoxybenzoyl)amino]pyridine-3-carboxylic acid
CID 102881937
2-fluoro-N,4-dimethoxybenzamide
CID 103606176
N-(2-amino-4-hydroxyphenyl)-2-fluoro-4-methoxybenzamide
CID 107697209
N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide
CID 102881866
N-(5-amino-2-pyridinyl)-3,4-dimethoxybenzamide
CID 43144619
2-bromo-N-(5-fluoro-2-pyridinyl)-5-methoxybenzamide
CID 62877597
N-(3-amino-4-methoxyphenyl)-2-fluoro-4-methoxybenzamide
CID 103805146
N-(4-ethoxyphenyl)-2-fluoro-4-methoxybenzamide
CID 27843918
methyl N-(5-amino-2-pyridinyl)carbamate
CID 58772637
2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide
CID 89316590
2-amino-4-methoxy-N-pyrazin-2-ylbenzamide
CID 113305136
dimethyl 5-[(2-fluoro-4-methoxybenzoyl)amino]benzene-1,3-dicarboxylate
CID 17433803

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide?
The IUPAC name of N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide (CID 102881864) is N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide.
What is the SMILES notation for N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide?
The canonical SMILES for N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(N)cn2)c(F)c1.
What is the InChIKey of N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide?
The InChIKey is OZTOUQAHNBPMIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O2/c1-19-9-3-4-10(11(14)6-9)13(18)17-12-5-2-8(15)7-16-12/h2-7H,15H2,1H3,(H,16,17,18).
What are the key properties of N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide?
N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide has a molecular weight of 261.26 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-pyridinyl)-2-fluoro-4-methoxybenzamide is sourced from PubChem (CID 102881864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).