1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide

C23H25FN6O2 — CID 54756253

IUPAC1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(c2c(F)cccc2NC(=O)c2ncc(-c3ccnc(C)c3)[nH]2)CC1
InChIInChI=1S/C23H25FN6O2/c1-14-12-16(6-9-26-14)19-13-27-21(28-19)23(32)29-18-5-3-4-17(24)20(18)30-10-7-15(8-11-30)22(31)25-2/h3-6,9,12-13,15H,7-8,10-11H2,1-2H3,(H,25,31)(H,27,28)(H,29,32)
InChIKeyZPZKMQRAVNAEGS-UHFFFAOYSA-N
MW436.49 g/mol
LogP3.13
Rot. Bonds5

About 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide

1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide (PubChem CID 54756253) has the molecular formula C23H25FN6O2 and a molecular weight of 436.49 g/mol. Its IUPAC name is 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide
PubChem CID54756253
Molecular FormulaC23H25FN6O2
Molecular Weight436.49 g/mol
Exact Mass436.20
IUPAC Name1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(c2c(F)cccc2NC(=O)c2ncc(-c3ccnc(C)c3)[nH]2)CC1
InChIInChI=1S/C23H25FN6O2/c1-14-12-16(6-9-26-14)19-13-27-21(28-19)23(32)29-18-5-3-4-17(24)20(18)30-10-7-15(8-11-30)22(31)25-2/h3-6,9,12-13,15H,7-8,10-11H2,1-2H3,(H,25,31)(H,27,28)(H,29,32)
InChIKeyZPZKMQRAVNAEGS-UHFFFAOYSA-N
XLogP3.13
TPSA103.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.49
LogP ≤ 53.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide with MolForge

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Related Compounds

1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N,N-dimethylpiperidine-4-carboxamide
CID 89456317
N-[2-[4-(aminomethyl)piperidin-1-yl]-3-fluorophenyl]-5-pyrimidin-5-yl-1H-imidazole-2-carboxamide
CID 54756015
N-[2-[4-(aminomethyl)piperidin-1-yl]-3-fluorophenyl]-5-(2-amino-6-methylpyrimidin-4-yl)-1H-imidazole-2-carboxamide
CID 54756128
N-[2-[(3R)-3-aminopiperidin-1-yl]-3-fluorophenyl]-5-(2-oxo-1H-pyridin-4-yl)-1H-imidazole-2-carboxamide
CID 54755655
N-[2-[(3R)-3-aminopiperidin-1-yl]-3-fluorophenyl]-5-[1-(pyridin-2-ylmethyl)pyrazol-4-yl]-1H-imidazole-2-carboxamide
CID 54755403
N-[2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-3-fluorophenyl]-5-(2-methyl-4-pyridinyl)-3H-pyrrole-2-carboxamide
CID 148802633
N-[2-[4-(aminomethyl)piperidin-1-yl]-3-fluorophenyl]-5-[6-[(3S)-3-(cyclohexylcarbamoyl)-3-methoxypyrrolidin-1-yl]-2-(methylamino)pyrimidin-4-yl]-1H-imidazole-2-carboxamide
CID 89456329
4-[3-(methylcarbamoyl)pyrrolidin-1-yl]pyridine-2-carboxamide
CID 171704184
1-(2-amino-3-fluorophenyl)-N-methylpiperidine-4-carboxamide
CID 60789324
N-(2-fluorophenyl)-2-[4-[(4-fluorophenyl)methylcarbamoyl]piperidin-1-yl]pyridine-4-carboxamide
CID 46360827
N-(2-fluorophenyl)-1-[2-(4-fluorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxamide
CID 46378549
1-(4-chloro-2-fluorophenyl)-N-(1-methylisoquinolin-5-yl)piperidine-4-carboxamide
CID 11560343

Frequently Asked Questions

What is the IUPAC name of 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide (CID 54756253) is 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide is CNC(=O)C1CCN(c2c(F)cccc2NC(=O)c2ncc(-c3ccnc(C)c3)[nH]2)CC1.
What is the InChIKey of 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide?
The InChIKey is ZPZKMQRAVNAEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN6O2/c1-14-12-16(6-9-26-14)19-13-27-21(28-19)23(32)29-18-5-3-4-17(24)20(18)30-10-7-15(8-11-30)22(31)25-2/h3-6,9,12-13,15H,7-8,10-11H2,1-2H3,(H,25,31)(H,27,28)(H,29,32).
What are the key properties of 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide?
1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide has a molecular weight of 436.49 g/mol, XLogP of 3.13, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-fluoro-6-[[5-(2-methyl-4-pyridinyl)-1H-imidazole-2-carbonyl]amino]phenyl]-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 54756253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).