N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide

C12H11FN4O — CID 65479896

IUPACN-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)Nc2ccc(F)cn2)ccn1
InChIInChI=1S/C12H11FN4O/c1-14-11-6-8(4-5-15-11)12(18)17-10-3-2-9(13)7-16-10/h2-7H,1H3,(H,14,15)(H,16,17,18)
InChIKeyGOLLRVVOLAHBEV-UHFFFAOYSA-N
MW246.25 g/mol
LogP1.91
Rot. Bonds3

About N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide

N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide (PubChem CID 65479896) has the molecular formula C12H11FN4O and a molecular weight of 246.25 g/mol. Its IUPAC name is N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide
PubChem CID65479896
Molecular FormulaC12H11FN4O
Molecular Weight246.25 g/mol
Exact Mass246.09
IUPAC NameN-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)Nc2ccc(F)cn2)ccn1
InChIInChI=1S/C12H11FN4O/c1-14-11-6-8(4-5-15-11)12(18)17-10-3-2-9(13)7-16-10/h2-7H,1H3,(H,14,15)(H,16,17,18)
InChIKeyGOLLRVVOLAHBEV-UHFFFAOYSA-N
XLogP1.91
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.25
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-fluoro-2-pyridinyl)-6-(methylamino)pyridine-3-carboxamide
CID 65482281
2-(aminomethyl)-N-(5-fluoro-2-pyridinyl)pyridine-4-carboxamide
CID 114326701
N-(2-bromo-4-fluorophenyl)-2-(methylamino)pyridine-4-carboxamide
CID 62165424
N-(5-fluoro-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 65479688
3,5-diamino-N-(5-fluoro-2-pyridinyl)benzamide
CID 65482634
3-bromo-N-(5-fluoro-2-pyridinyl)benzamide
CID 52886230
4-amino-3-fluoro-N-(5-fluoro-2-pyridinyl)benzamide
CID 65481834
N-(5-fluoro-2-pyridinyl)-4-(methylamino)pyridine-3-carboxamide
CID 81245310
N-(5-bromo-6-methyl-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide
CID 79049145
N-(3,5-dimethylphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 62167632
N-(4-bromo-2,5-difluorophenyl)-2-(methylamino)pyridine-4-carboxamide
CID 107616564
N-[2-(4-fluorophenyl)ethyl]-2-(methylamino)pyridine-4-carboxamide
CID 62185958

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide?
The IUPAC name of N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide (CID 65479896) is N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide is CNc1cc(C(=O)Nc2ccc(F)cn2)ccn1.
What is the InChIKey of N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide?
The InChIKey is GOLLRVVOLAHBEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN4O/c1-14-11-6-8(4-5-15-11)12(18)17-10-3-2-9(13)7-16-10/h2-7H,1H3,(H,14,15)(H,16,17,18).
What are the key properties of N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide?
N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide has a molecular weight of 246.25 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 65479896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).