N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide

C27H28N4O2 — CID 24541999

IUPACN-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)c1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C27H28N4O2/c32-27(29-23-12-15-30(16-13-23)18-21-7-2-1-3-8-21)22-9-6-10-25(17-22)33-20-24-19-31-14-5-4-11-26(31)28-24/h1-11,14,17,19,23H,12-13,15-16,18,20H2,(H,29,32)
InChIKeyTXTWYGDVJONZHM-UHFFFAOYSA-N
MW440.55 g/mol
LogP4.31
Rot. Bonds7

About N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide

N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide (PubChem CID 24541999) has the molecular formula C27H28N4O2 and a molecular weight of 440.55 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
PubChem CID24541999
Molecular FormulaC27H28N4O2
Molecular Weight440.55 g/mol
Exact Mass440.22
IUPAC NameN-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
SMILESO=C(NC1CCN(Cc2ccccc2)CC1)c1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C27H28N4O2/c32-27(29-23-12-15-30(16-13-23)18-21-7-2-1-3-8-21)22-9-6-10-25(17-22)33-20-24-19-31-14-5-4-11-26(31)28-24/h1-11,14,17,19,23H,12-13,15-16,18,20H2,(H,29,32)
InChIKeyTXTWYGDVJONZHM-UHFFFAOYSA-N
XLogP4.31
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.55
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[1-(3-methylbut-2-enyl)piperidin-4-yl]benzamide
CID 56569173
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-piperidin-4-ylbenzamide
CID 119388257
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide;dihydrochloride
CID 119457516
N-(1-benzylpiperidin-4-yl)-3-butoxybenzamide
CID 17176524
N-(1-benzylpiperidin-4-yl)imidazo[1,2-a]pyridine-2-carboxamide
CID 51254704
N-cyclopropyl-2-[4-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]piperazin-1-yl]acetamide
CID 55457840
N-[2-(aminomethyl)cyclopentyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 119603057
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 30582719
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 7063876
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide
CID 55493250
N-(4-ethylphenyl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 24542057
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[3-(methylamino)propyl]benzamide
CID 119431980

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide (CID 24541999) is N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide is O=C(NC1CCN(Cc2ccccc2)CC1)c1cccc(OCc2cn3ccccc3n2)c1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide?
The InChIKey is TXTWYGDVJONZHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28N4O2/c32-27(29-23-12-15-30(16-13-23)18-21-7-2-1-3-8-21)22-9-6-10-25(17-22)33-20-24-19-31-14-5-4-11-26(31)28-24/h1-11,14,17,19,23H,12-13,15-16,18,20H2,(H,29,32).
What are the key properties of N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide?
N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide has a molecular weight of 440.55 g/mol, XLogP of 4.31, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide is sourced from PubChem (CID 24541999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).