ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine

C22H26FN5 — CID 177316415

IUPACethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine
SMILESCC.CC.Cc1c(-c2cccnc2N)nc2ncc(-c3ccc(F)cc3)cn12
InChIInChI=1S/C18H14FN5.2C2H6/c1-11-16(15-3-2-8-21-17(15)20)23-18-22-9-13(10-24(11)18)12-4-6-14(19)7-5-12;2*1-2/h2-10H,1H3,(H2,20,21);2*1-2H3
InChIKeySLGYCAMSFSUUPE-UHFFFAOYSA-N
MW379.48 g/mol
LogP5.54
Rot. Bonds2

About ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine

ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine (PubChem CID 177316415) has the molecular formula C22H26FN5 and a molecular weight of 379.48 g/mol. Its IUPAC name is ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine.

Molecular Properties

Compound Nameethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine
PubChem CID177316415
Molecular FormulaC22H26FN5
Molecular Weight379.48 g/mol
Exact Mass379.22
IUPAC Nameethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine
SMILESCC.CC.Cc1c(-c2cccnc2N)nc2ncc(-c3ccc(F)cc3)cn12
InChIInChI=1S/C18H14FN5.2C2H6/c1-11-16(15-3-2-8-21-17(15)20)23-18-22-9-13(10-24(11)18)12-4-6-14(19)7-5-12;2*1-2/h2-10H,1H3,(H2,20,21);2*1-2H3
InChIKeySLGYCAMSFSUUPE-UHFFFAOYSA-N
XLogP5.54
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.48
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[6-(4-fluorophenyl)imidazo[1,2-a]pyridin-2-yl]pyridin-2-amine
CID 177316308
3-[1-chloro-3-[4-(chloromethyl)phenyl]-6-(4-fluorophenyl)indolizin-2-yl]pyridin-2-amine;ethane
CID 177316474
3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine
CID 69375800
ethane;3-[3-(5-fluoro-2-pyridinyl)-8-methylpyrrolo[1,2-a]pyrazin-7-yl]pyridin-2-amine
CID 177316248
3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
CID 97058185
3-[3-(4-fluorophenyl)-8-iodopyrrolo[1,2-a]pyrazin-7-yl]pyridin-2-amine
CID 177316140
3-[1-[4-(chloromethyl)phenyl]-6-(4-fluorophenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 177316980
3-[4-(4-fluoro-2-methylphenoxy)phenyl]pyridin-2-amine
CID 66747622
4-[2-(4-fluorophenyl)-3-pyridinyl]pyrimidin-2-amine
CID 10220968
2,3-dimethyl-6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrimidine
CID 142362621
2-[2-(4-fluorophenyl)imidazo[1,2-a]pyrimidin-3-yl]ethanamine
CID 82299531
3-(2-amino-3-pyridinyl)pyridin-2-amine
CID 1236677

Frequently Asked Questions

What is the IUPAC name of ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine?
The IUPAC name of ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine (CID 177316415) is ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine.
What is the SMILES notation for ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine?
The canonical SMILES for ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine is CC.CC.Cc1c(-c2cccnc2N)nc2ncc(-c3ccc(F)cc3)cn12.
What is the InChIKey of ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine?
The InChIKey is SLGYCAMSFSUUPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN5.2C2H6/c1-11-16(15-3-2-8-21-17(15)20)23-18-22-9-13(10-24(11)18)12-4-6-14(19)7-5-12;2*1-2/h2-10H,1H3,(H2,20,21);2*1-2H3.
What are the key properties of ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine?
ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine has a molecular weight of 379.48 g/mol, XLogP of 5.54, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-[6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrimidin-2-yl]pyridin-2-amine is sourced from PubChem (CID 177316415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).