N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide

C16H13FN6O — CID 11996474

IUPACN-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide
SMILESCc1cnc(Nc2cccnc2)c(C(=O)Nc2ccc(F)cn2)n1
InChIInChI=1S/C16H13FN6O/c1-10-7-20-15(22-12-3-2-6-18-9-12)14(21-10)16(24)23-13-5-4-11(17)8-19-13/h2-9H,1H3,(H,20,22)(H,19,23,24)
InChIKeyMMNBUEPTXPVKLB-UHFFFAOYSA-N
MW324.32 g/mol
LogP2.71
Rot. Bonds4

About N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide

N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide (PubChem CID 11996474) has the molecular formula C16H13FN6O and a molecular weight of 324.32 g/mol. Its IUPAC name is N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide
PubChem CID11996474
Molecular FormulaC16H13FN6O
Molecular Weight324.32 g/mol
Exact Mass324.11
IUPAC NameN-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide
SMILESCc1cnc(Nc2cccnc2)c(C(=O)Nc2ccc(F)cn2)n1
InChIInChI=1S/C16H13FN6O/c1-10-7-20-15(22-12-3-2-6-18-9-12)14(21-10)16(24)23-13-5-4-11(17)8-19-13/h2-9H,1H3,(H,20,22)(H,19,23,24)
InChIKeyMMNBUEPTXPVKLB-UHFFFAOYSA-N
XLogP2.71
TPSA92.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.32
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxylate
CID 67151989
[6-methyl-3-(pyridin-3-ylamino)-2-pyridinyl] N-(5-fluoro-2-pyridinyl)carbamate
CID 90114051
N-[5-(4-methylanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113031564
N-[5-(3-methylanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113031450
4-cyano-N-(5-fluoro-2-pyridinyl)-3,6-dimethylpyridine-2-carboxamide
CID 46899182
N-(5-fluoro-2-pyridinyl)-4-(methylamino)pyridine-3-carboxamide
CID 81245310
1-(6-methyl-3-pyridinyl)-3-pyridin-3-ylurea
CID 108865035
N-[5-(3-methoxyanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113034083
N-[5-[2-(dimethylamino)ethylamino]-2-pyridinyl]pyridine-3-carboxamide
CID 113025531
2-bromo-N-(5-fluoro-2-pyridinyl)pyridine-3-carboxamide
CID 103754643
4-[(5-fluoro-2-pyridinyl)carbamoyl]pyridine-3-carboxylic acid
CID 114244418
5-[(5-cyano-3-pyridinyl)amino]-N-(5-fluoro-2-pyridinyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 11530468

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide (CID 11996474) is N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide is Cc1cnc(Nc2cccnc2)c(C(=O)Nc2ccc(F)cn2)n1.
What is the InChIKey of N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide?
The InChIKey is MMNBUEPTXPVKLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN6O/c1-10-7-20-15(22-12-3-2-6-18-9-12)14(21-10)16(24)23-13-5-4-11(17)8-19-13/h2-9H,1H3,(H,20,22)(H,19,23,24).
What are the key properties of N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide?
N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide has a molecular weight of 324.32 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-pyridinyl)-6-methyl-3-(pyridin-3-ylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 11996474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).