6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide

C18H16FN5O2 — CID 69168909

IUPAC6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide
SMILESCc1c(F)cc(C(=O)Nc2ccnn2C)cc1-c1ccc(C(N)=O)cn1
InChIInChI=1S/C18H16FN5O2/c1-10-13(15-4-3-11(9-21-15)17(20)25)7-12(8-14(10)19)18(26)23-16-5-6-22-24(16)2/h3-9H,1-2H3,(H2,20,25)(H,23,26)
InChIKeyVUMPOTYVDVTCQO-UHFFFAOYSA-N
MW353.36 g/mol
LogP2.28
Rot. Bonds4

About 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide

6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide (PubChem CID 69168909) has the molecular formula C18H16FN5O2 and a molecular weight of 353.36 g/mol. Its IUPAC name is 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide
PubChem CID69168909
Molecular FormulaC18H16FN5O2
Molecular Weight353.36 g/mol
Exact Mass353.13
IUPAC Name6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide
SMILESCc1c(F)cc(C(=O)Nc2ccnn2C)cc1-c1ccc(C(N)=O)cn1
InChIInChI=1S/C18H16FN5O2/c1-10-13(15-4-3-11(9-21-15)17(20)25)7-12(8-14(10)19)18(26)23-16-5-6-22-24(16)2/h3-9H,1-2H3,(H2,20,25)(H,23,26)
InChIKeyVUMPOTYVDVTCQO-UHFFFAOYSA-N
XLogP2.28
TPSA102.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.36
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 103956818
3-[1-(2-chlorophenyl)benzotriazol-5-yl]-5-fluoro-4-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 25234486
4-hydrazinyl-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 63211576
3-fluoro-N-(2-methylpyrazol-3-yl)benzamide
CID 110472464
N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 110471287
3-[1-(4-fluorophenyl)phthalazin-6-yl]-4-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 66675486
3-fluoro-4-methyl-5-pyridazin-3-ylbenzamide
CID 145282408
3,4,5-trifluoro-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 63188295
N-(2,2-dimethylpropyl)-6-[3-fluoro-2-methyl-5-(prop-2-enylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 135283637
4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide
CID 110473266
ethane;methyl 3-[5-(2,2-dimethylpropylcarbamoyl)-2-pyridinyl]-5-fluoro-4-methylbenzoate
CID 143691455
2-N-[1-methyl-3-(1-methylimidazol-2-yl)pyrazol-5-yl]pyridine-2,5-dicarboxamide
CID 99638300

Frequently Asked Questions

What is the IUPAC name of 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide?
The IUPAC name of 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide (CID 69168909) is 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide is Cc1c(F)cc(C(=O)Nc2ccnn2C)cc1-c1ccc(C(N)=O)cn1.
What is the InChIKey of 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide?
The InChIKey is VUMPOTYVDVTCQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN5O2/c1-10-13(15-4-3-11(9-21-15)17(20)25)7-12(8-14(10)19)18(26)23-16-5-6-22-24(16)2/h3-9H,1-2H3,(H2,20,25)(H,23,26).
What are the key properties of 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide?
6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide has a molecular weight of 353.36 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-fluoro-2-methyl-5-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 69168909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).