N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide

C27H32FN5O2 — CID 169077653

IUPACN-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide
SMILESCc1cc(F)c(NC(=O)N2CCC(C3(C)CC3)C2)cc1-c1cc(N2CCOCC2)c2nccn2c1
InChIInChI=1S/C27H32FN5O2/c1-18-13-22(28)23(30-26(34)33-7-3-20(17-33)27(2)4-5-27)15-21(18)19-14-24(31-9-11-35-12-10-31)25-29-6-8-32(25)16-19/h6,8,13-16,20H,3-5,7,9-12,17H2,1-2H3,(H,30,34)
InChIKeyQPABDSNOMGEFHT-UHFFFAOYSA-N
MW477.58 g/mol
LogP4.94
Rot. Bonds4

About N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide

N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide (PubChem CID 169077653) has the molecular formula C27H32FN5O2 and a molecular weight of 477.58 g/mol. Its IUPAC name is N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide
PubChem CID169077653
Molecular FormulaC27H32FN5O2
Molecular Weight477.58 g/mol
Exact Mass477.25
IUPAC NameN-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide
SMILESCc1cc(F)c(NC(=O)N2CCC(C3(C)CC3)C2)cc1-c1cc(N2CCOCC2)c2nccn2c1
InChIInChI=1S/C27H32FN5O2/c1-18-13-22(28)23(30-26(34)33-7-3-20(17-33)27(2)4-5-27)15-21(18)19-14-24(31-9-11-35-12-10-31)25-29-6-8-32(25)16-19/h6,8,13-16,20H,3-5,7,9-12,17H2,1-2H3,(H,30,34)
InChIKeyQPABDSNOMGEFHT-UHFFFAOYSA-N
XLogP4.94
TPSA62.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.58
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[1-[difluoro(phosphanyl)methyl]cyclopropyl]-N-[2,4-dimethyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide
CID 170234750
(3R)-N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-1-propan-2-ylpyrrolidine-3-carboxamide
CID 169077628
1-tert-butyl-N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]triazole-4-carboxamide
CID 169077945
2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)benzamide
CID 169130860
N-[2-fluoro-4-methyl-5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyrrolidine-1-carboxamide
CID 169130879
2-(2-azabicyclo[2.1.1]hexan-2-yl)-N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide
CID 169077851
(3S)-N-[5-[2-(2,2-difluoroethyl)-8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl]-2-fluoro-4-methylphenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
CID 169077610
(5-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)anilino]methanol
CID 170092849
1-tert-butyl-5-fluoro-N-[2-fluoro-4-methyl-5-[8-(2-oxa-6-azaspiro[3.3]heptan-6-yl)imidazo[1,2-a]pyridin-6-yl]phenyl]pyrazole-4-carboxamide
CID 169077749
N-[2-fluoro-4-methyl-5-[5-morpholin-4-yl-6-(oxan-4-yloxy)-3-pyridinyl]phenyl]-3-(2-isocyanopropan-2-yl)pyrrolidine-1-carboxamide
CID 167395811
1-tert-butyl-3-fluoro-N-[5-fluoro-4-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]pyrazole-4-carboxamide
CID 169077818
N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-1-(trifluoromethyl)pyrrole-3-carboxamide
CID 170234775

Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide (CID 169077653) is N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide is Cc1cc(F)c(NC(=O)N2CCC(C3(C)CC3)C2)cc1-c1cc(N2CCOCC2)c2nccn2c1.
What is the InChIKey of N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide?
The InChIKey is QPABDSNOMGEFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32FN5O2/c1-18-13-22(28)23(30-26(34)33-7-3-20(17-33)27(2)4-5-27)15-21(18)19-14-24(31-9-11-35-12-10-31)25-29-6-8-32(25)16-19/h6,8,13-16,20H,3-5,7,9-12,17H2,1-2H3,(H,30,34).
What are the key properties of N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide?
N-[2-fluoro-4-methyl-5-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide has a molecular weight of 477.58 g/mol, XLogP of 4.94, 4 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-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]-3-(1-methylcyclopropyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 169077653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).