N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine

C20H23FN6O — CID 163322960

IUPACN-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine
SMILESCC1CN(c2ccc3ncc(-c4nc(NC5CC5)ncc4F)n3c2)CC(C)O1
InChIInChI=1S/C20H23FN6O/c1-12-9-26(10-13(2)28-12)15-5-6-18-22-8-17(27(18)11-15)19-16(21)7-23-20(25-19)24-14-3-4-14/h5-8,11-14H,3-4,9-10H2,1-2H3,(H,23,24,25)
InChIKeyFGJJNENGFKPMHC-UHFFFAOYSA-N
MW382.44 g/mol
LogP3.12
Rot. Bonds4

About N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine

N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine (PubChem CID 163322960) has the molecular formula C20H23FN6O and a molecular weight of 382.44 g/mol. Its IUPAC name is N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine
PubChem CID163322960
Molecular FormulaC20H23FN6O
Molecular Weight382.44 g/mol
Exact Mass382.19
IUPAC NameN-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine
SMILESCC1CN(c2ccc3ncc(-c4nc(NC5CC5)ncc4F)n3c2)CC(C)O1
InChIInChI=1S/C20H23FN6O/c1-12-9-26(10-13(2)28-12)15-5-6-18-22-8-17(27(18)11-15)19-16(21)7-23-20(25-19)24-14-3-4-14/h5-8,11-14H,3-4,9-10H2,1-2H3,(H,23,24,25)
InChIKeyFGJJNENGFKPMHC-UHFFFAOYSA-N
XLogP3.12
TPSA67.58 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine?
The IUPAC name of N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine (CID 163322960) is N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine.
What is the SMILES notation for N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine?
The canonical SMILES for N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine is CC1CN(c2ccc3ncc(-c4nc(NC5CC5)ncc4F)n3c2)CC(C)O1.
What is the InChIKey of N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine?
The InChIKey is FGJJNENGFKPMHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN6O/c1-12-9-26(10-13(2)28-12)15-5-6-18-22-8-17(27(18)11-15)19-16(21)7-23-20(25-19)24-14-3-4-14/h5-8,11-14H,3-4,9-10H2,1-2H3,(H,23,24,25).
What are the key properties of N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine?
N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine has a molecular weight of 382.44 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[6-(2,6-dimethylmorpholin-4-yl)imidazo[1,2-a]pyridin-3-yl]-5-fluoropyrimidin-2-amine is sourced from PubChem (CID 163322960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).