N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide

C26H25N5O3 — CID 55972840

IUPACN-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccc1NC(=O)N1CCCC1)c1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C26H25N5O3/c32-25(28-22-10-1-2-11-23(22)29-26(33)30-13-5-6-14-30)19-8-7-9-21(16-19)34-18-20-17-31-15-4-3-12-24(31)27-20/h1-4,7-12,15-17H,5-6,13-14,18H2,(H,28,32)(H,29,33)
InChIKeyMBITYBCEQLSIQZ-UHFFFAOYSA-N
MW455.52 g/mol
LogP4.79
Rot. Bonds6

About N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide

N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide (PubChem CID 55972840) has the molecular formula C26H25N5O3 and a molecular weight of 455.52 g/mol. Its IUPAC name is N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide
PubChem CID55972840
Molecular FormulaC26H25N5O3
Molecular Weight455.52 g/mol
Exact Mass455.20
IUPAC NameN-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccc1NC(=O)N1CCCC1)c1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C26H25N5O3/c32-25(28-22-10-1-2-11-23(22)29-26(33)30-13-5-6-14-30)19-8-7-9-21(16-19)34-18-20-17-31-15-4-3-12-24(31)27-20/h1-4,7-12,15-17H,5-6,13-14,18H2,(H,28,32)(H,29,33)
InChIKeyMBITYBCEQLSIQZ-UHFFFAOYSA-N
XLogP4.79
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500455.52
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethylphenyl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 24542057
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(2,4,6-trimethylphenyl)benzamide
CID 78829643
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 7063876
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[4-methyl-2-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 60574905
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[4-(methylsulfamoyl)phenyl]benzamide
CID 27711748
cyclobutyl-[4-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]piperazin-1-yl]methanone
CID 56512574
N-[(2-chlorophenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 24542001
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-piperidin-4-ylbenzamide
CID 119388257
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-pentylbenzamide
CID 134009641
N-[2-(aminomethyl)cyclopentyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 119603057
methyl 2-[[3-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]benzoyl]amino]acetate
CID 55848603
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide
CID 55493250

Frequently Asked Questions

What is the IUPAC name of N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide (CID 55972840) is N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide is O=C(Nc1ccccc1NC(=O)N1CCCC1)c1cccc(OCc2cn3ccccc3n2)c1.
What is the InChIKey of N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide?
The InChIKey is MBITYBCEQLSIQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N5O3/c32-25(28-22-10-1-2-11-23(22)29-26(33)30-13-5-6-14-30)19-8-7-9-21(16-19)34-18-20-17-31-15-4-3-12-24(31)27-20/h1-4,7-12,15-17H,5-6,13-14,18H2,(H,28,32)(H,29,33).
What are the key properties of N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide?
N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide has a molecular weight of 455.52 g/mol, XLogP of 4.79, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]phenyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 55972840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).