N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C21H18F2N6O — CID 138008172

IUPACN-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)NC3CCc4nc(-c5ccc(F)cc5F)cn4C3)cnn2c1
InChIInChI=1S/C21H18F2N6O/c1-12-7-24-20-16(8-25-29(20)9-12)21(30)26-14-3-5-19-27-18(11-28(19)10-14)15-4-2-13(22)6-17(15)23/h2,4,6-9,11,14H,3,5,10H2,1H3,(H,26,30)
InChIKeyLMRLOZVRHZWHHZ-UHFFFAOYSA-N
MW408.41 g/mol
LogP2.92
Rot. Bonds3

About N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 138008172) has the molecular formula C21H18F2N6O and a molecular weight of 408.41 g/mol. Its IUPAC name is N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID138008172
Molecular FormulaC21H18F2N6O
Molecular Weight408.41 g/mol
Exact Mass408.15
IUPAC NameN-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)NC3CCc4nc(-c5ccc(F)cc5F)cn4C3)cnn2c1
InChIInChI=1S/C21H18F2N6O/c1-12-7-24-20-16(8-25-29(20)9-12)21(30)26-14-3-5-19-27-18(11-28(19)10-14)15-4-2-13(22)6-17(15)23/h2,4,6-9,11,14H,3,5,10H2,1H3,(H,26,30)
InChIKeyLMRLOZVRHZWHHZ-UHFFFAOYSA-N
XLogP2.92
TPSA77.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.41
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

4-[[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]carbamoylamino]butanoic acid
CID 122016560
1-(1-amino-4-methylpentan-2-yl)-3-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]urea
CID 167881223
2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 154744117
2-[4-[[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]carbamoylamino]piperidin-1-yl]-N-methylacetamide
CID 167877881
N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-imidazol-1-ylpropanamide
CID 167907568
N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 59509139
1-[4-[[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]amino]piperidin-1-yl]-2-methylpropan-2-ol;2,2,2-trifluoroacetic acid
CID 167855827
5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine
CID 167776957
2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide
CID 95136799
N-(6-azabicyclo[3.2.1]octan-2-yl)-2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine;2,2,2-trifluoroacetic acid
CID 167773693
3-(2,4-difluorophenyl)-N-(4-hydroxycyclohexyl)-1-methylpyrazole-4-carboxamide
CID 111137730
2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide
CID 95135738

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 138008172) is N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cnc2c(C(=O)NC3CCc4nc(-c5ccc(F)cc5F)cn4C3)cnn2c1.
What is the InChIKey of N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is LMRLOZVRHZWHHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18F2N6O/c1-12-7-24-20-16(8-25-29(20)9-12)21(30)26-14-3-5-19-27-18(11-28(19)10-14)15-4-2-13(22)6-17(15)23/h2,4,6-9,11,14H,3,5,10H2,1H3,(H,26,30).
What are the key properties of N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 408.41 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-6-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 138008172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).