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

C26H25N7O — CID 175115105

IUPACN-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
SMILESCNC(=O)c1ccnc2c(C(C)CNc3cc(-c4ccn5c(C)cnc5c4)ncn3)cccc12
InChIInChI=1S/C26H25N7O/c1-16(19-5-4-6-20-21(26(34)27-3)7-9-28-25(19)20)13-29-23-12-22(31-15-32-23)18-8-10-33-17(2)14-30-24(33)11-18/h4-12,14-16H,13H2,1-3H3,(H,27,34)(H,29,31,32)
InChIKeyIDIOQPYNGPYSQS-UHFFFAOYSA-N
MW451.53 g/mol
LogP4.22
Rot. Bonds6

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

N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide (PubChem CID 175115105) has the molecular formula C26H25N7O and a molecular weight of 451.53 g/mol. Its IUPAC name is N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide.

Molecular Properties

Compound NameN-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
PubChem CID175115105
Molecular FormulaC26H25N7O
Molecular Weight451.53 g/mol
Exact Mass451.21
IUPAC NameN-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
SMILESCNC(=O)c1ccnc2c(C(C)CNc3cc(-c4ccn5c(C)cnc5c4)ncn3)cccc12
InChIInChI=1S/C26H25N7O/c1-16(19-5-4-6-20-21(26(34)27-3)7-9-28-25(19)20)13-29-23-12-22(31-15-32-23)18-8-10-33-17(2)14-30-24(33)11-18/h4-12,14-16H,13H2,1-3H3,(H,27,34)(H,29,31,32)
InChIKeyIDIOQPYNGPYSQS-UHFFFAOYSA-N
XLogP4.22
TPSA97.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.53
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

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
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-[(2R)-1-[(6-pyrazolo[1,5-a]pyrimidin-6-ylpyrimidin-4-yl)amino]propan-2-yl]quinoline-4-carboxamide
CID 156697410
N-methyl-8-[(2S)-1-[[6-[5-methyl-6-(methylamino)-3-pyridinyl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 118982913
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
N-methyl-8-[(2S)-1-[[6-(6-oxo-1H-pyridin-3-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 118982798
8-[(2S)-1-[[6-[5-(hydroxymethyl)-3-pyridinyl]pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide
CID 118982910
N-methyl-8-[(2S)-1-[[6-[2-(propan-2-yloxymethyl)pyrimidin-5-yl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide;sulfane
CID 160747089
8-[(2S)-1-[[6-(2-methoxy-6-methyl-4-pyridinyl)pyrimidin-4-yl]amino]propan-2-yl]-N-methylquinoline-4-carboxamide
CID 118982830
N-methyl-8-[1-[[6-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide
CID 123955080

Frequently Asked Questions

What is the IUPAC name of N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide?
The IUPAC name of 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) is N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide.
What is the SMILES notation for N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide?
The canonical SMILES for N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide is CNC(=O)c1ccnc2c(C(C)CNc3cc(-c4ccn5c(C)cnc5c4)ncn3)cccc12.
What is the InChIKey of N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide?
The InChIKey is IDIOQPYNGPYSQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N7O/c1-16(19-5-4-6-20-21(26(34)27-3)7-9-28-25(19)20)13-29-23-12-22(31-15-32-23)18-8-10-33-17(2)14-30-24(33)11-18/h4-12,14-16H,13H2,1-3H3,(H,27,34)(H,29,31,32).
What are the key properties of N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide?
N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide has a molecular weight of 451.53 g/mol, XLogP of 4.22, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-8-[1-[[6-(3-methylimidazo[1,2-a]pyridin-7-yl)pyrimidin-4-yl]amino]propan-2-yl]quinoline-4-carboxamide is sourced from PubChem (CID 175115105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).