N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide

C25H23F2N5O3 — CID 154655340

IUPACN-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide
SMILESC[C@@H](COc1cc2nc(C3CC3)cn2cc1NC(=O)c1cccc(C(F)F)n1)n1ccccc1=O
InChIInChI=1S/C25H23F2N5O3/c1-15(32-10-3-2-7-23(32)33)14-35-21-11-22-29-19(16-8-9-16)12-31(22)13-20(21)30-25(34)18-6-4-5-17(28-18)24(26)27/h2-7,10-13,15-16,24H,8-9,14H2,1H3,(H,30,34)/t15-/m0/s1
InChIKeyKTKOEORZOBGOJV-HNNXBMFYSA-N
MW479.49 g/mol
LogP4.60
Rot. Bonds8

About N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide

N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide (PubChem CID 154655340) has the molecular formula C25H23F2N5O3 and a molecular weight of 479.49 g/mol. Its IUPAC name is N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide
PubChem CID154655340
Molecular FormulaC25H23F2N5O3
Molecular Weight479.49 g/mol
Exact Mass479.18
IUPAC NameN-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide
SMILESC[C@@H](COc1cc2nc(C3CC3)cn2cc1NC(=O)c1cccc(C(F)F)n1)n1ccccc1=O
InChIInChI=1S/C25H23F2N5O3/c1-15(32-10-3-2-7-23(32)33)14-35-21-11-22-29-19(16-8-9-16)12-31(22)13-20(21)30-25(34)18-6-4-5-17(28-18)24(26)27/h2-7,10-13,15-16,24H,8-9,14H2,1H3,(H,30,34)/t15-/m0/s1
InChIKeyKTKOEORZOBGOJV-HNNXBMFYSA-N
XLogP4.60
TPSA90.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.49
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide with MolForge

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Related Compounds

6-(difluoromethyl)-N-[7-(2-methylpropoxy)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
CID 154655195
6-(difluoromethyl)-N-[2-(oxolan-3-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
CID 154655212
N-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-4-[2-[6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridin-7-yl]oxyethyl]-6-methoxypyridine-2-carboxamide
CID 154655795
2-[2-cyclopropyl-7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-6-yl]-1-[6-(difluoromethyl)-2-pyridinyl]ethanone
CID 164979534
methyl 3-[6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-7-ethoxyimidazo[1,2-a]pyridin-2-yl]propanoate
CID 154655144
N-[2-(3,3-difluorocyclobutyl)-7-ethoxyimidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
CID 164996643
N-[2-[4-(hydroxymethyl)cyclohexyl]-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 166468053
3-[2-[2-cyclopropyl-6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-3-fluoroimidazo[1,2-a]pyridin-7-yl]oxyethyl]-N-(2-cyclopropyl-8-ethoxyimidazo[1,2-a]pyridin-6-yl)-6-(difluoromethyl)pyridine-2-carboxamide
CID 155010163
6-(difluoromethyl)-N-[7-ethoxy-2-[1-(hydroxymethyl)cyclopropyl]imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 1-[6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-7-ethoxyimidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxylate
CID 164993718
N-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-1-propan-2-ylpyrazole-3-carboxamide
CID 154655076
N-[2-(3,3-difluorocyclobutyl)-7-ethoxyimidazo[1,2-a]pyridin-6-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 154655358
N-(2-cyclopropyl-8-methoxyimidazo[1,2-a]pyrazin-6-yl)-6-(difluoromethyl)pyridine-2-carboxamide
CID 154655470

Frequently Asked Questions

What is the IUPAC name of N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide (CID 154655340) is N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide is C[C@@H](COc1cc2nc(C3CC3)cn2cc1NC(=O)c1cccc(C(F)F)n1)n1ccccc1=O.
What is the InChIKey of N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide?
The InChIKey is KTKOEORZOBGOJV-HNNXBMFYSA-N. The full InChI is InChI=1S/C25H23F2N5O3/c1-15(32-10-3-2-7-23(32)33)14-35-21-11-22-29-19(16-8-9-16)12-31(22)13-20(21)30-25(34)18-6-4-5-17(28-18)24(26)27/h2-7,10-13,15-16,24H,8-9,14H2,1H3,(H,30,34)/t15-/m0/s1.
What are the key properties of N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide?
N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide has a molecular weight of 479.49 g/mol, XLogP of 4.60, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-cyclopropyl-7-[(2S)-2-(2-oxo-1-pyridinyl)propoxy]imidazo[1,2-a]pyridin-6-yl]-6-(difluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 154655340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).