8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide

C26H24FN7O — CID 175118377

IUPAC8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide
SMILESCNC(=O)c1ccnc2c(C(C)CNc3cc(-c4ccn5c(F)c(C)nc5c4)ncn3)cccc12
InChIInChI=1S/C26H24FN7O/c1-15(18-5-4-6-19-20(26(35)28-3)7-9-29-24(18)19)13-30-22-12-21(31-14-32-22)17-8-10-34-23(11-17)33-16(2)25(34)27/h4-12,14-15H,13H2,1-3H3,(H,28,35)(H,30,31,32)
InChIKeyUGYFUODVVUREEM-UHFFFAOYSA-N
MW469.52 g/mol
LogP4.36
Rot. Bonds6

About 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide

8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide (PubChem CID 175118377) has the molecular formula C26H24FN7O and a molecular weight of 469.52 g/mol. Its IUPAC name is 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide.

Molecular Properties

Compound Name8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide
PubChem CID175118377
Molecular FormulaC26H24FN7O
Molecular Weight469.52 g/mol
Exact Mass469.20
IUPAC Name8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide
SMILESCNC(=O)c1ccnc2c(C(C)CNc3cc(-c4ccn5c(F)c(C)nc5c4)ncn3)cccc12
InChIInChI=1S/C26H24FN7O/c1-15(18-5-4-6-19-20(26(35)28-3)7-9-29-24(18)19)13-30-22-12-21(31-14-32-22)17-8-10-34-23(11-17)33-16(2)25(34)27/h4-12,14-15H,13H2,1-3H3,(H,28,35)(H,30,31,32)
InChIKeyUGYFUODVVUREEM-UHFFFAOYSA-N
XLogP4.36
TPSA97.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500469.52
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide with MolForge

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Related Compounds

N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 175115105
8-[(2S)-1-[[6-(2-methoxy-6-methyl-4-pyridinyl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide
CID 118982830
8-[(2S)-1-[[6-(3,5-difluoro-4-propan-2-yloxyphenyl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide
CID 118982835
N-methyl-8-[1-[(6-pyrrolo[1,2-a]pyrimidin-3-ylpyrimidin-4-yl)amino]propan-2-yl]quinoline-4-carboxamide
CID 156697391
N-methyl-8-[(2S)-1-[[6-[5-methyl-6-(methylamino)-3-pyridinyl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 118982913
N-methyl-8-[(2S)-1-[[6-(6-oxo-1H-pyridin-3-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 118982798
N-methyl-8-[(2R)-1-[(6-pyrazolo[1,5-a]pyrimidin-6-ylpyrimidin-4-yl)amino]propan-2-yl]quinoline-4-carboxamide
CID 156697410
N-methyl-8-[1-[[6-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 123955080
8-[(2S)-1-[[6-[2-(dimethylamino)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide
CID 118982808
N-methyl-8-[1-[[6-[6-[2-(methylamino)ethylamino]-3-pyridinyl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 130428762
N-methyl-8-[(2S)-1-[[6-[6-(2-pyrrol-1-ylethylamino)-3-pyridinyl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 118982721
8-[(2S)-1-[[6-[2-(cyclopropylmethyl)-4-pyridinyl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide;sulfane
CID 160703235

Frequently Asked Questions

What is the IUPAC name of 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide?
The IUPAC name of 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide (CID 175118377) is 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide.
What is the SMILES notation for 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide?
The canonical SMILES for 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide is CNC(=O)c1ccnc2c(C(C)CNc3cc(-c4ccn5c(F)c(C)nc5c4)ncn3)cccc12.
What is the InChIKey of 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide?
The InChIKey is UGYFUODVVUREEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24FN7O/c1-15(18-5-4-6-19-20(26(35)28-3)7-9-29-24(18)19)13-30-22-12-21(31-14-32-22)17-8-10-34-23(11-17)33-16(2)25(34)27/h4-12,14-15H,13H2,1-3H3,(H,28,35)(H,30,31,32).
What are the key properties of 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide?
8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide has a molecular weight of 469.52 g/mol, XLogP of 4.36, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[1-[[6-(3-fluoro-2-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide is sourced from PubChem (CID 175118377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).