(8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

C25H24ClF2N5O — CID 162561705

IUPAC(8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESCOc1nc(-c2cn3c(n2)[C@@H](c2ccc(Cl)cc2C(C)(F)F)CCC3)ccc1-n1cnc(C)c1
InChIInChI=1S/C25H24ClF2N5O/c1-15-12-33(14-29-15)22-9-8-20(31-24(22)34-3)21-13-32-10-4-5-18(23(32)30-21)17-7-6-16(26)11-19(17)25(2,27)28/h6-9,11-14,18H,4-5,10H2,1-3H3/t18-/m1/s1
InChIKeyFNMBFOXKIDEYMH-GOSISDBHSA-N
MW483.95 g/mol
LogP6.14
Rot. Bonds5

About (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

(8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (PubChem CID 162561705) has the molecular formula C25H24ClF2N5O and a molecular weight of 483.95 g/mol. Its IUPAC name is (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name(8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
PubChem CID162561705
Molecular FormulaC25H24ClF2N5O
Molecular Weight483.95 g/mol
Exact Mass483.16
IUPAC Name(8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESCOc1nc(-c2cn3c(n2)[C@@H](c2ccc(Cl)cc2C(C)(F)F)CCC3)ccc1-n1cnc(C)c1
InChIInChI=1S/C25H24ClF2N5O/c1-15-12-33(14-29-15)22-9-8-20(31-24(22)34-3)21-13-32-10-4-5-18(23(32)30-21)17-7-6-16(26)11-19(17)25(2,27)28/h6-9,11-14,18H,4-5,10H2,1-3H3/t18-/m1/s1
InChIKeyFNMBFOXKIDEYMH-GOSISDBHSA-N
XLogP6.14
TPSA57.76 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500483.95
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine with MolForge

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Related Compounds

E-2212
CID 46854987
(8S)-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-8-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
CID 49872384
(8R)-8-(4-fluorophenyl)-2-[(E)-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]ethenyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
CID 57609154
(8R)-2-[(E)-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]ethenyl]-8-(3,4,5-trifluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
CID 57609159
4-chloro-N-(cyclopropylmethyl)-3-[(8R)-2-[6-methoxy-5-(4-methylimidazol-1-yl)pyridin-2-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-N-(2,2,2-trifluoroethyl)aniline
CID 68073534
4-chloro-N,N-bis(cyclopropylmethyl)-3-[(8R)-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]aniline
CID 68073538
[4-Chloro-2-methoxy-3-[[4-(trifluoromethyl)piperidin-1-yl]methyl]quinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol
CID 118022672
5-(4-chlorophenyl)-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6-dihydro-2H-1,2,4-oxadiazine
CID 124127338
5-(3-chloro-4-fluorophenyl)-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6-dihydro-2H-1,2,4-oxadiazine
CID 124127340
5-(4-chloro-3-fluorophenyl)-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6-dihydro-2H-1,2,4-oxadiazine
CID 124127381
5-[4-chloro-3-(trifluoromethyl)phenyl]-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6-dihydro-2H-1,2,4-oxadiazine
CID 124134186
5-(3-chlorophenyl)-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6-dihydro-2H-1,2,4-oxadiazine
CID 124134324

Frequently Asked Questions

What is the IUPAC name of (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The IUPAC name of (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (CID 162561705) is (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The canonical SMILES for (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is COc1nc(-c2cn3c(n2)[C@@H](c2ccc(Cl)cc2C(C)(F)F)CCC3)ccc1-n1cnc(C)c1.
What is the InChIKey of (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The InChIKey is FNMBFOXKIDEYMH-GOSISDBHSA-N. The full InChI is InChI=1S/C25H24ClF2N5O/c1-15-12-33(14-29-15)22-9-8-20(31-24(22)34-3)21-13-32-10-4-5-18(23(32)30-21)17-7-6-16(26)11-19(17)25(2,27)28/h6-9,11-14,18H,4-5,10H2,1-3H3/t18-/m1/s1.
What are the key properties of (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
(8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine has a molecular weight of 483.95 g/mol, XLogP of 6.14, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-8-[4-chloro-2-(1,1-difluoroethyl)phenyl]-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 162561705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).