2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine

C22H16FN5O2 — CID 67004842

IUPAC2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine
SMILESCOc1cc(Nc2cncn3cc(-c4ccc(F)cc4)nc23)ccc1-c1cnco1
InChIInChI=1S/C22H16FN5O2/c1-29-20-8-16(6-7-17(20)21-10-25-13-30-21)26-18-9-24-12-28-11-19(27-22(18)28)14-2-4-15(23)5-3-14/h2-13,26H,1H3
InChIKeyLLPJIHMKCIWZSD-UHFFFAOYSA-N
MW401.40 g/mol
LogP4.94
Rot. Bonds5

About 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine

2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine (PubChem CID 67004842) has the molecular formula C22H16FN5O2 and a molecular weight of 401.40 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine
PubChem CID67004842
Molecular FormulaC22H16FN5O2
Molecular Weight401.40 g/mol
Exact Mass401.13
IUPAC Name2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine
SMILESCOc1cc(Nc2cncn3cc(-c4ccc(F)cc4)nc23)ccc1-c1cnco1
InChIInChI=1S/C22H16FN5O2/c1-29-20-8-16(6-7-17(20)21-10-25-13-30-21)26-18-9-24-12-28-11-19(27-22(18)28)14-2-4-15(23)5-3-14/h2-13,26H,1H3
InChIKeyLLPJIHMKCIWZSD-UHFFFAOYSA-N
XLogP4.94
TPSA77.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.40
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(4-fluorophenyl)-N-[3-methoxy-4-(2-methylimidazol-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine
CID 67414536
4-methoxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-6-phenyl-1,3,5-triazin-2-amine
CID 22459608
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-5-phenyl-1,3,4-oxadiazol-2-amine
CID 22459619
N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473196
4-chloro-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-6-phenyl-1,3,5-triazin-2-amine
CID 22459751
5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methyl-1,3-oxazol-5-yl)benzaldehyde
CID 91268630
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-5-methyl-1,3-benzoxazol-2-amine
CID 23563141
[5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methyl-1,3-oxazol-5-yl)phenyl]methanol
CID 58515566
2-(4-fluorophenyl)-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]imidazo[1,2-a]pyrazin-8-amine
CID 67414569
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-5-pyridin-2-yl-1,3-oxazol-2-amine
CID 10125842
1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-[(4-methylphenyl)methyl]urea
CID 12051287
ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole
CID 143041662

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine?
The IUPAC name of 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine (CID 67004842) is 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine?
The canonical SMILES for 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine is COc1cc(Nc2cncn3cc(-c4ccc(F)cc4)nc23)ccc1-c1cnco1.
What is the InChIKey of 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine?
The InChIKey is LLPJIHMKCIWZSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16FN5O2/c1-29-20-8-16(6-7-17(20)21-10-25-13-30-21)26-18-9-24-12-28-11-19(27-22(18)28)14-2-4-15(23)5-3-14/h2-13,26H,1H3.
What are the key properties of 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine?
2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine has a molecular weight of 401.40 g/mol, XLogP of 4.94, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]imidazo[1,2-c]pyrimidin-8-amine is sourced from PubChem (CID 67004842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).