N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide

C24H28FN5O2 — CID 169130879

IUPACN-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide
SMILESCc1cn2cc(-c3cc(NC(=O)N4CCCC4)c(F)cc3C)cc(N3CCOCC3)c2n1
InChIInChI=1S/C24H28FN5O2/c1-16-11-20(25)21(27-24(31)29-5-3-4-6-29)13-19(16)18-12-22(28-7-9-32-10-8-28)23-26-17(2)14-30(23)15-18/h11-15H,3-10H2,1-2H3,(H,27,31)
InChIKeyWRRVEIFMQCXGAF-UHFFFAOYSA-N
MW437.52 g/mol
LogP4.22
Rot. Bonds3

About N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide

N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide (PubChem CID 169130879) has the molecular formula C24H28FN5O2 and a molecular weight of 437.52 g/mol. Its IUPAC name is N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide
PubChem CID169130879
Molecular FormulaC24H28FN5O2
Molecular Weight437.52 g/mol
Exact Mass437.22
IUPAC NameN-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide
SMILESCc1cn2cc(-c3cc(NC(=O)N4CCCC4)c(F)cc3C)cc(N3CCOCC3)c2n1
InChIInChI=1S/C24H28FN5O2/c1-16-11-20(25)21(27-24(31)29-5-3-4-6-29)13-19(16)18-12-22(28-7-9-32-10-8-28)23-26-17(2)14-30(23)15-18/h11-15H,3-10H2,1-2H3,(H,27,31)
InChIKeyWRRVEIFMQCXGAF-UHFFFAOYSA-N
XLogP4.22
TPSA62.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.52
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide (CID 169130879) is N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide is Cc1cn2cc(-c3cc(NC(=O)N4CCCC4)c(F)cc3C)cc(N3CCOCC3)c2n1.
What is the InChIKey of N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide?
The InChIKey is WRRVEIFMQCXGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28FN5O2/c1-16-11-20(25)21(27-24(31)29-5-3-4-6-29)13-19(16)18-12-22(28-7-9-32-10-8-28)23-26-17(2)14-30(23)15-18/h11-15H,3-10H2,1-2H3,(H,27,31).
What are the key properties of N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide?
N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide has a molecular weight of 437.52 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 169130879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).