6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide

C13H11ClFN3O — CID 62161597

IUPAC6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide
SMILESCN(C(=O)c1nc(N)ccc1Cl)c1ccccc1F
InChIInChI=1S/C13H11ClFN3O/c1-18(10-5-3-2-4-9(10)15)13(19)12-8(14)6-7-11(16)17-12/h2-7H,1H3,(H2,16,17)
InChIKeySBLKNEDHNICSTR-UHFFFAOYSA-N
MW279.70 g/mol
LogP2.73
Rot. Bonds2

About 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide

6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide (PubChem CID 62161597) has the molecular formula C13H11ClFN3O and a molecular weight of 279.70 g/mol. Its IUPAC name is 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide
PubChem CID62161597
Molecular FormulaC13H11ClFN3O
Molecular Weight279.70 g/mol
Exact Mass279.06
IUPAC Name6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide
SMILESCN(C(=O)c1nc(N)ccc1Cl)c1ccccc1F
InChIInChI=1S/C13H11ClFN3O/c1-18(10-5-3-2-4-9(10)15)13(19)12-8(14)6-7-11(16)17-12/h2-7H,1H3,(H2,16,17)
InChIKeySBLKNEDHNICSTR-UHFFFAOYSA-N
XLogP2.73
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.70
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-3-chloro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 62160447
6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide
CID 62154422
6-amino-3-chloro-N-[1-(2-chlorophenyl)ethyl]-N-methylpyridine-2-carboxamide
CID 62980332
6-amino-N-[(2-bromophenyl)methyl]-3-chloro-N-methylpyridine-2-carboxamide
CID 62160440
6-amino-3-chloro-N-methyl-N-(2-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 79487639
3-chloro-6-hydrazinyl-N-(2-methoxyphenyl)-N-methylpyridine-2-carboxamide
CID 62249084
6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62153910
N-(2-fluorophenyl)-2,6-dihydroxy-N-methylbenzamide
CID 107689336
2-chloro-N-(2-fluorophenyl)-N-methyl-6-(methylamino)pyridine-4-carboxamide
CID 62175854
6-amino-N,N-dibutyl-3-chloropyridine-2-carboxamide
CID 55042068
6-amino-3-chloro-N-(5-hydroxypentyl)-N-methylpyridine-2-carboxamide
CID 107201186
6-amino-3-chloro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-carboxamide
CID 112664231

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide (CID 62161597) is 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide is CN(C(=O)c1nc(N)ccc1Cl)c1ccccc1F.
What is the InChIKey of 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide?
The InChIKey is SBLKNEDHNICSTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFN3O/c1-18(10-5-3-2-4-9(10)15)13(19)12-8(14)6-7-11(16)17-12/h2-7H,1H3,(H2,16,17).
What are the key properties of 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide?
6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide has a molecular weight of 279.70 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-(2-fluorophenyl)-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 62161597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).