4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide

C18H21FN4O — CID 58997364

IUPAC4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide
SMILESCN(c1cccc(NC(=O)c2ccc(F)cc2)n1)C1CCNCC1
InChIInChI=1S/C18H21FN4O/c1-23(15-9-11-20-12-10-15)17-4-2-3-16(21-17)22-18(24)13-5-7-14(19)8-6-13/h2-8,15,20H,9-12H2,1H3,(H,21,22,24)
InChIKeySOHNLXVQKBDGCW-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.66
Rot. Bonds4

About 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide

4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide (PubChem CID 58997364) has the molecular formula C18H21FN4O and a molecular weight of 328.39 g/mol. Its IUPAC name is 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide
PubChem CID58997364
Molecular FormulaC18H21FN4O
Molecular Weight328.39 g/mol
Exact Mass328.17
IUPAC Name4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide
SMILESCN(c1cccc(NC(=O)c2ccc(F)cc2)n1)C1CCNCC1
InChIInChI=1S/C18H21FN4O/c1-23(15-9-11-20-12-10-15)17-4-2-3-16(21-17)22-18(24)13-5-7-14(19)8-6-13/h2-8,15,20H,9-12H2,1H3,(H,21,22,24)
InChIKeySOHNLXVQKBDGCW-UHFFFAOYSA-N
XLogP2.66
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-[methyl-(1-methylpiperidin-4-yl)amino]-2-pyridinyl]pyridine-4-carboxamide;hydrochloride
CID 66939123
6-[(4-fluorobenzoyl)amino]pyridine-2-carboxylic acid
CID 63643772
N-[6-[methyl-(1-methylpiperidin-4-yl)amino]-2-pyridinyl]cyclobutanecarboxamide
CID 58997278
4-(4-fluorophenoxy)-N-(6-methyl-2-pyridinyl)benzamide
CID 35505697
1-(4-fluorophenyl)-2-[6-[methyl-(1-propylpiperidin-4-yl)amino]-2-pyridinyl]ethanone;hydrochloride
CID 159206943
4-[methyl(pyridin-4-yl)amino]-N-[6-[phosphanyl(pyridin-4-yl)amino]-2-pyridinyl]benzamide
CID 170229365
N-[6-[methyl-(1-methylpiperidin-4-yl)amino]-2-pyridinyl]benzenecarbothioamide;hydrochloride
CID 87481232
1-N-(2-aminopyrimidin-5-yl)-4-N-methyl-4-N-piperidin-4-ylbenzene-1,4-dicarboxamide
CID 162705843
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-[methyl(piperidin-4-yl)amino]pyrazine-2-carboxamide
CID 163683694
N-[6-[(1,1-dioxothiolan-3-yl)-methylamino]-3-pyridinyl]-4-fluorobenzamide
CID 113013680
N-methyl-N-piperidin-4-ylpyridin-2-amine;hydrochloride
CID 71641470
piperidin-4-yl 3-[(4-fluorobenzoyl)amino]benzoate;hydrochloride
CID 102560121

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide?
The IUPAC name of 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide (CID 58997364) is 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide?
The canonical SMILES for 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide is CN(c1cccc(NC(=O)c2ccc(F)cc2)n1)C1CCNCC1.
What is the InChIKey of 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide?
The InChIKey is SOHNLXVQKBDGCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN4O/c1-23(15-9-11-20-12-10-15)17-4-2-3-16(21-17)22-18(24)13-5-7-14(19)8-6-13/h2-8,15,20H,9-12H2,1H3,(H,21,22,24).
What are the key properties of 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide?
4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide has a molecular weight of 328.39 g/mol, XLogP of 2.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[6-[methyl(piperidin-4-yl)amino]-2-pyridinyl]benzamide is sourced from PubChem (CID 58997364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).