N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine

C18H22FN7O — CID 169143666

IUPACN-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine
SMILESF[C@H]1CC[C@@H](c2cc(Nc3nc(N4CCOCC4)cc4nccn34)n[nH]2)C1
InChIInChI=1S/C18H22FN7O/c19-13-2-1-12(9-13)14-10-15(24-23-14)21-18-22-17(25-5-7-27-8-6-25)11-16-20-3-4-26(16)18/h3-4,10-13H,1-2,5-9H2,(H2,21,22,23,24)/t12-,13+/m1/s1
InChIKeyVQXGQASIHTZNEA-OLZOCXBDSA-N
MW371.42 g/mol
LogP2.64
Rot. Bonds4

About N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine

N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine (PubChem CID 169143666) has the molecular formula C18H22FN7O and a molecular weight of 371.42 g/mol. Its IUPAC name is N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine.

Molecular Properties

Compound NameN-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine
PubChem CID169143666
Molecular FormulaC18H22FN7O
Molecular Weight371.42 g/mol
Exact Mass371.19
IUPAC NameN-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine
SMILESF[C@H]1CC[C@@H](c2cc(Nc3nc(N4CCOCC4)cc4nccn34)n[nH]2)C1
InChIInChI=1S/C18H22FN7O/c19-13-2-1-12(9-13)14-10-15(24-23-14)21-18-22-17(25-5-7-27-8-6-25)11-16-20-3-4-26(16)18/h3-4,10-13H,1-2,5-9H2,(H2,21,22,23,24)/t12-,13+/m1/s1
InChIKeyVQXGQASIHTZNEA-OLZOCXBDSA-N
XLogP2.64
TPSA83.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.42
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[(4-fluorophenyl)-morpholin-4-ylmethyl]-N-(5-methyl-1H-pyrazol-3-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 45101415
3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine
CID 58033252
2-[difluoro-(4-fluorophenyl)methyl]-N-(5-methyl-1H-pyrazol-3-yl)-6-(morpholin-4-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 58494336
2-[1-(4-fluorophenyl)-3-morpholin-4-ylpropyl]-N-(1H-pyrazol-5-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 58494486
3-[(4-fluorophenyl)methyl]-N-(5-methyl-1H-pyrazol-3-yl)-8-(morpholin-4-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 73054783
3-[(2,4-difluorophenyl)methyl]-N-(5-methyl-1H-pyrazol-3-yl)-8-(morpholin-4-ylmethyl)imidazo[1,2-b]pyridazin-6-amine
CID 73055066
2-[difluoro-(4-fluorophenyl)methyl]-N-(5-methyl-1H-pyrazol-3-yl)-6-(2-morpholin-4-ylethyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 91088985
3-[(1R)-1-(2,4-difluorophenyl)ethyl]-2-methyl-N-(1-methylimidazol-4-yl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 118295416
3-[1-(2,4-difluorophenyl)ethyl]-2-methyl-N-(1-methylimidazol-4-yl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 118295417
3-[(2-fluorophenyl)methyl]-2-methyl-N-(1-methylimidazol-4-yl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 118295427
3-[(4-fluorophenyl)methyl]-2-methyl-N-(1-methylimidazol-4-yl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 118295437
3-[(1S)-1-(4-fluorophenyl)ethyl]-2-methyl-N-(1-methylimidazol-4-yl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 118295449

Frequently Asked Questions

What is the IUPAC name of N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine?
The IUPAC name of N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine (CID 169143666) is N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine.
What is the SMILES notation for N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine?
The canonical SMILES for N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine is F[C@H]1CC[C@@H](c2cc(Nc3nc(N4CCOCC4)cc4nccn34)n[nH]2)C1.
What is the InChIKey of N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine?
The InChIKey is VQXGQASIHTZNEA-OLZOCXBDSA-N. The full InChI is InChI=1S/C18H22FN7O/c19-13-2-1-12(9-13)14-10-15(24-23-14)21-18-22-17(25-5-7-27-8-6-25)11-16-20-3-4-26(16)18/h3-4,10-13H,1-2,5-9H2,(H2,21,22,23,24)/t12-,13+/m1/s1.
What are the key properties of N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine?
N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine has a molecular weight of 371.42 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(1R,3S)-3-fluorocyclopentyl]-1H-pyrazol-3-yl]-7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-amine is sourced from PubChem (CID 169143666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).