5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide

C18H19FN4O — CID 146420199

IUPAC5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide
SMILESCN1CCC(=Cc2cccc(NC(=O)c3ccc(F)cn3)n2)CC1
InChIInChI=1S/C18H19FN4O/c1-23-9-7-13(8-10-23)11-15-3-2-4-17(21-15)22-18(24)16-6-5-14(19)12-20-16/h2-6,11-12H,7-10H2,1H3,(H,21,22,24)
InChIKeyIOAVUFWIWDVFHC-UHFFFAOYSA-N
MW326.38 g/mol
LogP2.98
Rot. Bonds3

About 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide

5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide (PubChem CID 146420199) has the molecular formula C18H19FN4O and a molecular weight of 326.38 g/mol. Its IUPAC name is 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide
PubChem CID146420199
Molecular FormulaC18H19FN4O
Molecular Weight326.38 g/mol
Exact Mass326.15
IUPAC Name5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide
SMILESCN1CCC(=Cc2cccc(NC(=O)c3ccc(F)cn3)n2)CC1
InChIInChI=1S/C18H19FN4O/c1-23-9-7-13(8-10-23)11-15-3-2-4-17(21-15)22-18(24)16-6-5-14(19)12-20-16/h2-6,11-12H,7-10H2,1H3,(H,21,22,24)
InChIKeyIOAVUFWIWDVFHC-UHFFFAOYSA-N
XLogP2.98
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-6-[(5-fluoropyridine-2-carbonyl)amino]benzoic acid
CID 104638146
6-chloro-N-(5-fluoro-2-pyridinyl)pyridine-2-carboxamide
CID 63236254
formaldehyde;2,4,6-trifluoro-N-[6-(1-methylpiperidine-4-carbonyl)-2-pyridinyl]benzamide
CID 155570632
2,6-difluoro-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]benzamide
CID 86992589
2,4,6-trifluoro-N-[6-[(1-methylpiperidin-4-yl)amino]-2-pyridinyl]benzamide;dihydrochloride
CID 66939247
6-[(4-fluorobenzoyl)amino]pyridine-2-carboxylic acid
CID 63643772
N-[2,6-di(propan-2-yl)phenyl]-5-(4-methylpiperazin-1-yl)pyridine-2-carboxamide
CID 109186575
5-fluoro-N-(2-hydroxy-6-nitrophenyl)pyridine-2-carboxamide
CID 107681305
N-[6-[N-amino-N-(1-hydroxypropan-2-yl)-N'-methylcarbamimidoyl]-2-pyridinyl]-6-methyl-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide
CID 142483687
N-(5-fluoro-2-pyridinyl)-4-hydroxy-1,5-dimethyl-2,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide
CID 170254985
5-fluoro-N-(5-fluoro-2-pyridinyl)-4-(2-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 171091313
ethane;methanamine;2,4,6-trifluoro-N-[6-[hydroxy-(4-methylpiperazin-1-yl)methyl]-2-pyridinyl]benzamide
CID 178016549

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide?
The IUPAC name of 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide (CID 146420199) is 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide?
The canonical SMILES for 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide is CN1CCC(=Cc2cccc(NC(=O)c3ccc(F)cn3)n2)CC1.
What is the InChIKey of 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide?
The InChIKey is IOAVUFWIWDVFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN4O/c1-23-9-7-13(8-10-23)11-15-3-2-4-17(21-15)22-18(24)16-6-5-14(19)12-20-16/h2-6,11-12H,7-10H2,1H3,(H,21,22,24).
What are the key properties of 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide?
5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide has a molecular weight of 326.38 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[6-[(1-methylpiperidin-4-ylidene)methyl]-2-pyridinyl]pyridine-2-carboxamide is sourced from PubChem (CID 146420199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).