N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

C25H26N4O2 — CID 56541690

IUPACN-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
SMILESCc1cccn2cc(COc3ccccc3C(=O)NCCCNc3ccccc3)nc12
InChIInChI=1S/C25H26N4O2/c1-19-9-7-16-29-17-21(28-24(19)29)18-31-23-13-6-5-12-22(23)25(30)27-15-8-14-26-20-10-3-2-4-11-20/h2-7,9-13,16-17,26H,8,14-15,18H2,1H3,(H,27,30)
InChIKeyALJJTPUTPVUHGZ-UHFFFAOYSA-N
MW414.51 g/mol
LogP4.45
Rot. Bonds9

About N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (PubChem CID 56541690) has the molecular formula C25H26N4O2 and a molecular weight of 414.51 g/mol. Its IUPAC name is N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
PubChem CID56541690
Molecular FormulaC25H26N4O2
Molecular Weight414.51 g/mol
Exact Mass414.21
IUPAC NameN-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
SMILESCc1cccn2cc(COc3ccccc3C(=O)NCCCNc3ccccc3)nc12
InChIInChI=1S/C25H26N4O2/c1-19-9-7-16-29-17-21(28-24(19)29)18-31-23-13-6-5-12-22(23)25(30)27-15-8-14-26-20-10-3-2-4-11-20/h2-7,9-13,16-17,26H,8,14-15,18H2,1H3,(H,27,30)
InChIKeyALJJTPUTPVUHGZ-UHFFFAOYSA-N
XLogP4.45
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.51
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
CID 119502756
N-(2-amino-2-methylpropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 119628901
N-[2-[(4-hydroxybenzoyl)amino]ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 138044528
N-[(4-fluorophenyl)methyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24616146
N-[3-(2-methylbenzimidazol-1-yl)propyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 55522635
N-(3-fluoro-4-methylphenyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24617135
N-[2-(methylamino)propyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
CID 120831701
N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 55635787
2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide
CID 42939373
2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[(1-phenylpyrazol-4-yl)methyl]benzamide
CID 37141097
N-[4-(methylcarbamoyl)phenyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 18278813
N-(3-ethynylphenyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 33230598

Frequently Asked Questions

What is the IUPAC name of N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The IUPAC name of N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (CID 56541690) is N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.
What is the SMILES notation for N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The canonical SMILES for N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is Cc1cccn2cc(COc3ccccc3C(=O)NCCCNc3ccccc3)nc12.
What is the InChIKey of N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The InChIKey is ALJJTPUTPVUHGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O2/c1-19-9-7-16-29-17-21(28-24(19)29)18-31-23-13-6-5-12-22(23)25(30)27-15-8-14-26-20-10-3-2-4-11-20/h2-7,9-13,16-17,26H,8,14-15,18H2,1H3,(H,27,30).
What are the key properties of N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide has a molecular weight of 414.51 g/mol, XLogP of 4.45, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is sourced from PubChem (CID 56541690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).